N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]benzamide Formula: C22H23N5O4S MolecularWeight: 453.51412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C22H23N5O4S/c1-15-6-8-18(9-7-15)27-20(12-16(2)25-27)24-22(29)17-4-3-5-19(13-17)32(30,31)26-11-10-23-21(28)14-26/h3-9,12-13H,10-11,14H2,1-2H3,(H,23,28)(H,24,29)