N-(4-acetamido-3-methyl-phenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-acetamido-3-methyl-phenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-acetamido-3-methyl-phenyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(4-acetamido-3-methylphenyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(4-acetamido-3-methylphenyl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(4-acetamido-3-methyl-phenyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3)NC(=O)C

InChI

InChI=1S/C20H22N4O5S/c1-13-10-16(6-7-18(13)22-14(2)25)23-20(27)15-4-3-5-17(11-15)30(28,29)24-9-8-21-19(26)12-24/h3-7,10-11H,8-9,12H2,1-2H3,(H,21,26)(H,22,25)(H,23,27)