N-[4-[(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]phenyl]ethanamide Openeye Name: N-[4-[(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]phenyl]acetamide CAS Name: N-[4-[(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]phenyl]acetamide IUPAC Name: N-[4-[(Z)-[1-(2-cyanoethyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]phenyl]acetamide Traditional Name: N-[4-[(Z)-[1-(2-cyanoethyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]phenyl]acetamide Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)NC(=O)C)CCC#N

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)NC(=O)C)CCC#N

InChI

InChI=1S/C16H16N4O2/c1-11-15(16(22)20(19-11)9-3-8-17)10-13-4-6-14(7-5-13)18-12(2)21/h4-7,10H,3,9H2,1-2H3,(H,18,21)/b15-10-