(3Z)-3-[[[4-(4-methylpiperazin-1-yl)phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-N-piperidin-4-yl-1H-indole-5-sulfonamide

Systemtic Name: (3Z)-3-[[[4-(4-methylpiperazin-1-yl)phenyl]amino]-phenyl-methylidene]-2-oxidanylidene-N-piperidin-4-yl-1H-indole-5-sulfonamide Openeye Name: (3Z)-3-[[4-(4-methylpiperazin-1-yl)anilino]-phenyl-methylene]-2-oxo-N-(4-piperidyl)indoline-5-sulfonamide CAS Name: (3Z)-3-[[4-(4-methyl-1-piperazinyl)anilino]-phenylmethylidene]-2-oxo-N-(4-piperidinyl)-1H-indole-5-sulfonamide IUPAC Name: (3Z)-3-[[4-(4-methylpiperazin-1-yl)anilino]-phenylmethylidene]-2-oxo-N-piperidin-4-yl-1H-indole-5-sulfonamide Traditional Name: (3Z)-2-keto-3-[[4-(4-methylpiperazino)anilino]-phenyl-methylene]-N-(4-piperidyl)indoline-5-sulfonamide Formula: C31H36N6O3S MolecularWeight: 572.72094

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=C3C4=C(C=CC(=C4)S(=O)(=O)NC5CCNCC5)NC3=O)C6=CC=CC=C6

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)N/C(=C\3/C4=C(C=CC(=C4)S(=O)(=O)NC5CCNCC5)NC3=O)/C6=CC=CC=C6

InChI

InChI=1S/C31H36N6O3S/c1-36-17-19-37(20-18-36)25-9-7-23(8-10-25)33-30(22-5-3-2-4-6-22)29-27-21-26(11-12-28(27)34-31(29)38)41(39,40)35-24-13-15-32-16-14-24/h2-12,21,24,32-33,35H,13-20H2,1H3,(H,34,38)/b30-29-