N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

InChI

InChI=1S/C26H33N3O4S/c1-20-13-14-21(34(32,33)29-17-9-4-10-18-29)19-23(20)25(30)27-24-12-6-5-11-22(24)26(31)28-15-7-2-3-8-16-28/h5-6,11-14,19H,2-4,7-10,15-18H2,1H3,(H,27,30)