N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-methylpiperidin-1-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-methylpiperidin-1-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-methyl-1-piperidyl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-(3-methyl-1-piperidinyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(3-methylpiperidin-1-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-methylpiperidino)acetamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1CCCN(C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H33N3O3S/c1-17-8-7-11-23(15-17)16-21(25)22-19-10-9-18(2)20(14-19)28(26,27)24-12-5-3-4-6-13-24/h9-10,14,17H,3-8,11-13,15-16H2,1-2H3,(H,22,25)