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

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-3-methyl-4-[(4-methylphenyl)sulfonylamino]benzamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-3-methyl-4-(p-tolylsulfonylamino)benzamide CAS Name: N-[2-(1-azepanyl)ethyl]-3-methyl-4-[(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-3-methyl-4-[(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-3-methyl-4-(tosylamino)benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S/c1-18-7-10-21(11-8-18)30(28,29)25-22-12-9-20(17-19(22)2)23(27)24-13-16-26-14-5-3-4-6-15-26/h7-12,17,25H,3-6,13-16H2,1-2H3,(H,24,27)