Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L3NDB7
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| Ligand Name |
Ispinesib mesylate
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| Synonyms |
Ispinesib mesylate; 514820-03-2; Ispinesib mesylate [USAN]; Ispinesib mesilate; R6ZMD4UH3D; SB 715992S; SB-715992-S; CK0238273; CK-0238273; Ispinesib mesylate (USAN); Benzamide, N-(3-aminopropyl)-N-((1R)-1-(7-chloro-3,4-dihydro-4-oxo-3-(phenylmethyl)-2-quinazolinyl)-2-methylpropyl)-4-methyl-, monomethanesulfonate; SB-715992; CK 0238273; Ispinesib (mesylate); CHEMBL2347651; (R)-N-(3-Aminopropyl)-N-(1-(3-benzyl-7-chloro-4-oxo-3,4-dihydroquinazolin-2-yl)-2-methylpropyl)-4-methylbenzamide methanesulfonate; UNII-R6ZMD4UH3D; SCHEMBL2963210; DTXSID70199455; ISPINESIB MESILATE [WHO-DD]; D04640; Q27287868; (R)-N-(3-amino-propyl)-N-[1-(3-benzyl-7-chloro-4-oxo-3,4-dihydro-quinazolin-2-yl)-2-methyl-propyl]-4-methyl-benzamide, mesylate salt; N-(3-AMINOPROPYL)-N-((1R)-1-(3-BENZYL-7-CHLORO-4-OXO-3,4-DIHYDROQUINAZOLIN-2-YL)-2-METHYLPROPYL)-4-METHYLBENZAMIDE MONOMETHANESULPHONATE; n-(3-aminopropyl)-n-[(1r)-1-(3-benzyl-7-chloro-4-oxo-3,4-dihydroquinazolin-2-yl)-2-methylpropyl]-4-methylbenzamide monomethanesulfonate
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| Structure |
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Download2D MOL
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| Formula |
C31H37ClN4O5S
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| Canonical SMILES |
CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4=CC=CC=C4)C(C)C.CS(=O)(=O)O
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| InChI |
1S/C30H33ClN4O2.CH4O3S/c1-20(2)27(34(17-7-16-32)29(36)23-12-10-21(3)11-13-23)28-33-26-18-24(31)14-15-25(26)30(37)35(28)19-22-8-5-4-6-9-22;1-5(2,3)4/h4-6,8-15,18,20,27H,7,16-17,19,32H2,1-3H3;1H3,(H,2,3,4)/t27-;/m1./s1
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| InChIKey |
MRKSDPIHUJSKRA-HZPIKELBSA-N
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| PubChem Compound ID | ||||
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