N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-benzamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O5S/c1-15-6-8-17(9-7-15)23-20(27)13-24(2)21(28)16-4-3-5-18(12-16)31(29,30)25-11-10-22-19(26)14-25/h3-9,12H,10-11,13-14H2,1-2H3,(H,22,26)(H,23,27)