N-[3-(azepan-1-yl)propyl]-4-methyl-3-(phenylsulfonylamino)benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-methyl-3-(phenylsulfonylamino)benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-3-(benzenesulfonamido)-4-methyl-benzamide CAS Name: N-[3-(1-azepanyl)propyl]-3-(benzenesulfonamido)-4-methylbenzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-3-(benzenesulfonamido)-4-methylbenzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-3-(benzenesulfonamido)-4-methyl-benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCCN2CCCCCC2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCCN2CCCCCC2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-19-12-13-20(18-22(19)25-30(28,29)21-10-5-4-6-11-21)23(27)24-14-9-17-26-15-7-2-3-8-16-26/h4-6,10-13,18,25H,2-3,7-9,14-17H2,1H3,(H,24,27)