methyl 2-[(E)-2-cyano-3-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 2-[(E)-2-cyano-3-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 2-[(E)-2-cyano-3-[[5-methyl-2-(p-tolyl)pyrazol-3-yl]amino]-3-oxo-prop-1-enyl]benzoate CAS Name: 2-[(E)-2-cyano-3-[[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]amino]-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(E)-2-cyano-3-[[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]amino]-3-oxoprop-1-enyl]benzoate Traditional Name: 2-[(E)-2-cyano-3-keto-3-[[5-methyl-2-(p-tolyl)pyrazol-3-yl]amino]prop-1-enyl]benzoic acid methyl ester Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)C(=CC3=CC=CC=C3C(=O)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)/C(=C/C3=CC=CC=C3C(=O)OC)/C#N

InChI

InChI=1S/C23H20N4O3/c1-15-8-10-19(11-9-15)27-21(12-16(2)26-27)25-22(28)18(14-24)13-17-6-4-5-7-20(17)23(29)30-3/h4-13H,1-3H3,(H,25,28)/b18-13+