N-(2-ethyl-6-methyl-phenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2-ethyl-6-methylphenyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)C

InChI

InChI=1S/C20H23N3O4S/c1-3-15-7-4-6-14(2)19(15)22-20(25)16-8-5-9-17(12-16)28(26,27)23-11-10-21-18(24)13-23/h4-9,12H,3,10-11,13H2,1-2H3,(H,21,24)(H,22,25)