Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4W5KD
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| Ligand Name |
N-{[2-(2-amino-3,4-dioxocyclobut-1-en-1-yl)-1,2,3,4-tetrahydroisoquinolin-7-yl]methyl}-4-oxo-3,5,6,8-tetrahydro-4h-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2-carboxamide 7,7-dioxide
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| Synonyms |
N-{[2-(2-amino-3,4-dioxocyclobut-1-en-1-yl)-1,2,3,4-tetrahydroisoquinolin-7-yl]methyl}-4-oxo-3,5,6,8-tetrahydro-4h-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2-carboxamide 7,7-dioxide; AXB; thiopyranothienopyrimidine, 1; CHEMBL460725; SCHEMBL13155217; BDBM27877; Q27458111; N-{[2-(2-amino-3,4-dioxocyclobut-1-en-1-yl)-1,2,3,4-tetrahydroisoquinolin-7-yl]methyl}-3,11,11-trioxo-8,11$l^{6}-dithia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-triene-5-carboxamide
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| Structure |
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Download2D MOL |
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| Formula |
C24H21N5O6S2
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| Canonical SMILES |
C1CN(CC2=C1C=CC(=C2)CNC(=O)C3=NC4=C(C5=C(S4)CS(=O)(=O)CC5)C(=O)N3)C6=C(C(=O)C6=O)N
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| InChI |
1S/C24H21N5O6S2/c25-17-18(20(31)19(17)30)29-5-3-12-2-1-11(7-13(12)9-29)8-26-23(33)21-27-22(32)16-14-4-6-37(34,35)10-15(14)36-24(16)28-21/h1-2,7H,3-6,8-10,25H2,(H,26,33)(H,27,28,32)
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| InChIKey |
QHDIXGPUTSAIJX-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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