N,N-bis(2-cyanoethyl)-3-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N,N-bis(2-cyanoethyl)-3-(3,5-dimethylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N,N-bis(2-cyanoethyl)-3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzamide CAS Name: N,N-bis(2-cyanoethyl)-3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N,N-bis(2-cyanoethyl)-3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N,N-bis(2-cyanoethyl)-3-(3,5-dimethylpiperidino)sulfonyl-benzamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CCC#N)CCC#N)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CCC#N)CCC#N)C

InChI

InChI=1S/C20H26N4O3S/c1-16-12-17(2)15-24(14-16)28(26,27)19-7-3-6-18(13-19)20(25)23(10-4-8-21)11-5-9-22/h3,6-7,13,16-17H,4-5,10-12,14-15H2,1-2H3