5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[3-[methyl-(phenylmethyl)amino]propyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-chloranyl-N-[3-[methyl-(phenylmethyl)amino]propyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[3-[benzyl(methyl)amino]propyl]-2-chloro-benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-chloro-N-[3-[methyl-(phenylmethyl)amino]propyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[3-[benzyl(methyl)amino]propyl]-2-chlorobenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[3-[benzyl(methyl)amino]propyl]-2-chloro-benzamide Formula: C24H32ClN3O3S MolecularWeight: 478.04718

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C24H32ClN3O3S/c1-27(19-20-10-5-4-6-11-20)15-9-14-26-24(29)22-18-21(12-13-23(22)25)32(30,31)28-16-7-2-3-8-17-28/h4-6,10-13,18H,2-3,7-9,14-17,19H2,1H3,(H,26,29)