N-[2-(azepan-1-yl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-3-(p-tolylsulfonylamino)benzamide CAS Name: N-[2-(1-azepanyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-3-(tosylamino)benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCCN3CCCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCCN3CCCCCC3

InChI

InChI=1S/C22H29N3O3S/c1-18-9-11-21(12-10-18)29(27,28)24-20-8-6-7-19(17-20)22(26)23-13-16-25-14-4-2-3-5-15-25/h6-12,17,24H,2-5,13-16H2,1H3,(H,23,26)