2-(azepan-1-yl)-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-(azepan-1-yl)-N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]acetamide CAS Name: 2-(1-azepanyl)-N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-(azepan-1-yl)-N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]acetamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCCCCC3)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCCCCC3)C

InChI

InChI=1S/C21H33N3O3S/c1-17-8-7-9-18(2)24(17)28(26,27)20-12-10-19(11-13-20)22-21(25)16-23-14-5-3-4-6-15-23/h10-13,17-18H,3-9,14-16H2,1-2H3,(H,22,25)