10-methyl-3-oxidanylidene-4-(3-piperidin-1-ylpropyl)-N-(3-propan-2-yloxypropyl)-5H-[1,4]thiazepino[7,6-b]indole-5-carboxamide

Systemtic Name: 10-methyl-3-oxidanylidene-4-(3-piperidin-1-ylpropyl)-N-(3-propan-2-yloxypropyl)-5H-[1,4]thiazepino[7,6-b]indole-5-carboxamide Openeye Name: N-(3-isopropoxypropyl)-10-methyl-3-oxo-4-[3-(1-piperidyl)propyl]-5H-[1,4]thiazepino[7,6-b]indole-5-carboxamide CAS Name: 10-methyl-3-oxo-4-[3-(1-piperidinyl)propyl]-N-(3-propan-2-yloxypropyl)-5H-[1,4]thiazepino[7,6-b]indole-5-carboxamide IUPAC Name: 10-methyl-3-oxo-4-(3-piperidin-1-ylpropyl)-N-(3-propan-2-yloxypropyl)-5H-[1,4]thiazepino[7,6-b]indole-5-carboxamide Traditional Name: N-(3-isopropoxypropyl)-3-keto-10-methyl-4-(3-piperidinopropyl)-5H-[1,4]thiazepin[7,6-b]indole-5-carboxamide Formula: C27H40N4O3S MolecularWeight: 500.6965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1C2=C(N(C3=CC=CC=C32)C)SCC(=O)N1CCCN4CCCCC4

Isomeric SMILES

CC(C)OCCCNC(=O)C1C2=C(N(C3=CC=CC=C32)C)SCC(=O)N1CCCN4CCCCC4

InChI

InChI=1S/C27H40N4O3S/c1-20(2)34-18-9-13-28-26(33)25-24-21-11-5-6-12-22(21)29(3)27(24)35-19-23(32)31(25)17-10-16-30-14-7-4-8-15-30/h5-6,11-12,20,25H,4,7-10,13-19H2,1-3H3,(H,28,33)