2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(3-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(3-methylphenyl)methyl]ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-(m-tolylmethyl)acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-1-indolyl]-N-[(3-methylphenyl)methyl]acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-[(3-methylphenyl)methyl]acetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-(3-methylbenzyl)acetamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)CN2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H29N3O3S/c1-19-7-6-8-20(15-19)17-25-24(28)18-26-14-11-21-16-22(9-10-23(21)26)31(29,30)27-12-4-2-3-5-13-27/h6-11,14-16H,2-5,12-13,17-18H2,1H3,(H,25,28)