N-[3-(azepan-1-yl)propyl]-2-methyl-3-(phenylsulfonylamino)benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-methyl-3-(phenylsulfonylamino)benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-3-(benzenesulfonamido)-2-methyl-benzamide CAS Name: N-[3-(1-azepanyl)propyl]-3-(benzenesulfonamido)-2-methylbenzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-3-(benzenesulfonamido)-2-methylbenzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-3-(benzenesulfonamido)-2-methyl-benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC=C2)C(=O)NCCCN3CCCCCC3

Isomeric SMILES

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC=C2)C(=O)NCCCN3CCCCCC3

InChI

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