Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1PJ3A
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| Ligand Name |
3-[(2H-1,3-benzodioxol-5-yl)methyl]-8-fluoro-6-{[2-(4-methylpiperazin-1-yl)ethyl]amino}-1-(1,3-thiazol-2-yl)[1]benzopyrano[2,3-c]pyrrol-9(2H)-one
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| Synonyms |
3-[(2H-1,3-benzodioxol-5-yl)methyl]-8-fluoro-6-{[2-(4-methylpiperazin-1-yl)ethyl]amino}-1-(1,3-thiazol-2-yl)[1]benzopyrano[2,3-c]pyrrol-9(2H)-one; 9T9
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| Structure |
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Download2D MOL |
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| Formula |
C29H28FN5O4S
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| Canonical SMILES |
CN1CCN(CC1)CCNC2=CC3=C(C(=C2)F)C(=O)C4=C(NC(=C4O3)CC5=CC6=C(C=C5)OCO6)C7=NC=CS7
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| InChI |
1S/C29H28FN5O4S/c1-34-7-9-35(10-8-34)6-4-31-18-14-19(30)24-23(15-18)39-28-20(12-17-2-3-21-22(13-17)38-16-37-21)33-26(25(28)27(24)36)29-32-5-11-40-29/h2-3,5,11,13-15,31,33H,4,6-10,12,16H2,1H3
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| InChIKey |
PRRCSWFEDVEDKN-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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