N-[2-(cyclopentylmethylcarbamoyl)-5-(3-morpholin-4-yl-3-oxidanylidene-propyl)phenyl]sulfonyl-2-(indol-1-ylmethyl)-3-methoxy-benzamide

Systemtic Name: N-[2-(cyclopentylmethylcarbamoyl)-5-(3-morpholin-4-yl-3-oxidanylidene-propyl)phenyl]sulfonyl-2-(indol-1-ylmethyl)-3-methoxy-benzamide Openeye Name: N-[2-(cyclopentylmethylcarbamoyl)-5-(3-morpholino-3-oxo-propyl)phenyl]sulfonyl-2-(indol-1-ylmethyl)-3-methoxy-benzamide CAS Name: N-[2-[(cyclopentylmethylamino)-oxomethyl]-5-[3-(4-morpholinyl)-3-oxopropyl]phenyl]sulfonyl-2-(1-indolylmethyl)-3-methoxybenzamide IUPAC Name: N-[2-(cyclopentylmethylcarbamoyl)-5-(3-morpholin-4-yl-3-oxopropyl)phenyl]sulfonyl-2-(indol-1-ylmethyl)-3-methoxybenzamide Traditional Name: N-[2-(cyclopentylmethylcarbamoyl)-5-(3-keto-3-morpholino-propyl)phenyl]sulfonyl-2-(indol-1-ylmethyl)-3-methoxy-benzamide Formula: C37H42N4O7S MolecularWeight: 686.81698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CN2C=CC3=CC=CC=C32)C(=O)NS(=O)(=O)C4=C(C=CC(=C4)CCC(=O)N5CCOCC5)C(=O)NCC6CCCC6

Isomeric SMILES

COC1=CC=CC(=C1CN2C=CC3=CC=CC=C32)C(=O)NS(=O)(=O)C4=C(C=CC(=C4)CCC(=O)N5CCOCC5)C(=O)NCC6CCCC6

InChI

InChI=1S/C37H42N4O7S/c1-47-33-12-6-10-29(31(33)25-41-18-17-28-9-4-5-11-32(28)41)37(44)39-49(45,46)34-23-26(14-16-35(42)40-19-21-48-22-20-40)13-15-30(34)36(43)38-24-27-7-2-3-8-27/h4-6,9-13,15,17-18,23,27H,2-3,7-8,14,16,19-22,24-25H2,1H3,(H,38,43)(H,39,44)