4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide

Systemtic Name: 4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide Openeye Name: 4-chloro-3-[(3-methyl-1-piperidyl)sulfonyl]-N-[3-(2-oxoazepan-1-yl)propyl]benzamide CAS Name: 4-chloro-3-[(3-methyl-1-piperidinyl)sulfonyl]-N-[3-(2-oxo-1-azepanyl)propyl]benzamide IUPAC Name: 4-chloro-3-(3-methylpiperidin-1-yl)sulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]benzamide Traditional Name: 4-chloro-N-[3-(2-ketoazepan-1-yl)propyl]-3-(3-methylpiperidino)sulfonyl-benzamide Formula: C22H32ClN3O4S MolecularWeight: 470.02518

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCN3CCCCCC3=O)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCN3CCCCCC3=O)Cl

InChI

InChI=1S/C22H32ClN3O4S/c1-17-7-5-14-26(16-17)31(29,30)20-15-18(9-10-19(20)23)22(28)24-11-6-13-25-12-4-2-3-8-21(25)27/h9-10,15,17H,2-8,11-14,16H2,1H3,(H,24,28)