2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[2-(2-methylphenyl)ethyl]ethanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[2-(2-methylphenyl)ethyl]ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[2-(o-tolyl)ethyl]acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-1-indolyl]-N-[2-(2-methylphenyl)ethyl]acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[2-(2-methylphenyl)ethyl]acetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[2-(o-tolyl)ethyl]acetamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O3S/c1-20-8-4-5-9-21(20)12-14-26-25(29)19-27-17-13-22-18-23(10-11-24(22)27)32(30,31)28-15-6-2-3-7-16-28/h4-5,8-11,13,17-18H,2-3,6-7,12,14-16,19H2,1H3,(H,26,29)