ethyl 2-[[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-methyl-5-oxo-1-(p-tolyl)pyrazol-4-ylidene]methylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-methyl-1-(4-methylphenyl)-5-oxo-4-pyrazolylidene]methylamino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-methyl-1-(4-methylphenyl)-5-oxopyrazol-4-ylidene]methylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[5-keto-3-methyl-1-(p-tolyl)-2-pyrazolin-4-ylidene]methylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C25H23N3O3S/c1-4-31-25(30)22-21(18-8-6-5-7-9-18)15-32-23(22)26-14-20-17(3)27-28(24(20)29)19-12-10-16(2)11-13-19/h5-15,26H,4H2,1-3H3