N-[2-(azepan-1-ylcarbonyl)phenyl]-2-chloranyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-chloranyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-5-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-chloro-5-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-5-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-5-(4-methylpiperidino)sulfonyl-benzamide Formula: C26H32ClN3O4S MolecularWeight: 518.06798

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

InChI

InChI=1S/C26H32ClN3O4S/c1-19-12-16-30(17-13-19)35(33,34)20-10-11-23(27)22(18-20)25(31)28-24-9-5-4-8-21(24)26(32)29-14-6-2-3-7-15-29/h4-5,8-11,18-19H,2-3,6-7,12-17H2,1H3,(H,28,31)