4-(2-cyanoethanoylamino)-N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: 4-(2-cyanoethanoylamino)-N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: 4-[(2-cyanoacetyl)amino]-N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-N-methyl-benzamide CAS Name: 4-[(2-cyano-1-oxoethyl)amino]-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methylbenzamide IUPAC Name: 4-[(2-cyanoacetyl)amino]-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methylbenzamide Traditional Name: 4-[(2-cyanoacetyl)amino]-N-[2-(2,3-dimethylanilino)-2-keto-ethyl]-N-methyl-benzamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN(C)C(=O)C2=CC=C(C=C2)NC(=O)CC#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN(C)C(=O)C2=CC=C(C=C2)NC(=O)CC#N)C

InChI

InChI=1S/C21H22N4O3/c1-14-5-4-6-18(15(14)2)24-20(27)13-25(3)21(28)16-7-9-17(10-8-16)23-19(26)11-12-22/h4-10H,11,13H2,1-3H3,(H,23,26)(H,24,27)