N-(2,3-dimethylcyclohexyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(2,3-dimethylcyclohexyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2,3-dimethylcyclohexyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(2,3-dimethylcyclohexyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C19H27N3O4S/c1-13-5-3-8-17(14(13)2)21-19(24)15-6-4-7-16(11-15)27(25,26)22-10-9-20-18(23)12-22/h4,6-7,11,13-14,17H,3,5,8-10,12H2,1-2H3,(H,20,23)(H,21,24)