N-[3-(azepan-1-yl)propyl]-4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]benzamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-[[(3-chlorophenyl)-methylsulfonyl-amino]methyl]benzamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-[(3-chloro-N-methylsulfonyl-anilino)methyl]benzamide CAS Name: N-[3-(1-azepanyl)propyl]-4-[(3-chloro-N-methylsulfonylanilino)methyl]benzamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-[(3-chloro-N-methylsulfonylanilino)methyl]benzamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-[(3-chloro-N-mesyl-anilino)methyl]benzamide Formula: C24H32ClN3O3S MolecularWeight: 478.04718

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NCCCN2CCCCCC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)C(=O)NCCCN2CCCCCC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C24H32ClN3O3S/c1-32(30,31)28(23-9-6-8-22(25)18-23)19-20-10-12-21(13-11-20)24(29)26-14-7-17-27-15-4-2-3-5-16-27/h6,8-13,18H,2-5,7,14-17,19H2,1H3,(H,26,29)