5-(azepan-1-ylsulfonyl)-1-ethanoyl-N-(1-phenylethyl)-2,3-dihydroindole-2-carboxamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-1-ethanoyl-N-(1-phenylethyl)-2,3-dihydroindole-2-carboxamide Openeye Name: 1-acetyl-5-(azepan-1-ylsulfonyl)-N-(1-phenylethyl)indoline-2-carboxamide CAS Name: 1-acetyl-5-(1-azepanylsulfonyl)-N-(1-phenylethyl)-2,3-dihydroindole-2-carboxamide IUPAC Name: 1-acetyl-5-(azepan-1-ylsulfonyl)-N-(1-phenylethyl)-2,3-dihydroindole-2-carboxamide Traditional Name: 1-acetyl-5-(azepan-1-ylsulfonyl)-N-(1-phenylethyl)indoline-2-carboxamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2CC3=C(N2C(=O)C)C=CC(=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2CC3=C(N2C(=O)C)C=CC(=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O4S/c1-18(20-10-6-5-7-11-20)26-25(30)24-17-21-16-22(12-13-23(21)28(24)19(2)29)33(31,32)27-14-8-3-4-9-15-27/h5-7,10-13,16,18,24H,3-4,8-9,14-15,17H2,1-2H3,(H,26,30)