N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-1-methyl-7-[[4-(1-methylpiperidin-4-yl)carbonylpiperazin-1-yl]methyl]indole-2-carboxamide

Systemtic Name: N-[5-tert-butyl-2-methoxy-3-(methylsulfonylamino)phenyl]-1-methyl-7-[[4-(1-methylpiperidin-4-yl)carbonylpiperazin-1-yl]methyl]indole-2-carboxamide Openeye Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-1-methyl-7-[[4-(1-methylpiperidine-4-carbonyl)piperazin-1-yl]methyl]indole-2-carboxamide CAS Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-1-methyl-7-[[4-[(1-methyl-4-piperidinyl)-oxomethyl]-1-piperazinyl]methyl]-2-indolecarboxamide IUPAC Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-1-methyl-7-[[4-(1-methylpiperidine-4-carbonyl)piperazin-1-yl]methyl]indole-2-carboxamide Traditional Name: N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxy-phenyl]-1-methyl-7-[[4-(1-methylisonipecotoyl)piperazino]methyl]indole-2-carboxamide Formula: C34H48N6O5S MolecularWeight: 652.84712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC3=C(N2C)C(=CC=C3)CN4CCN(CC4)C(=O)C5CCN(CC5)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)NS(=O)(=O)C)OC)NC(=O)C2=CC3=C(N2C)C(=CC=C3)CN4CCN(CC4)C(=O)C5CCN(CC5)C

InChI

InChI=1S/C34H48N6O5S/c1-34(2,3)26-20-27(31(45-6)28(21-26)36-46(7,43)44)35-32(41)29-19-24-9-8-10-25(30(24)38(29)5)22-39-15-17-40(18-16-39)33(42)23-11-13-37(4)14-12-23/h8-10,19-21,23,36H,11-18,22H2,1-7H3,(H,35,41)