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

Systemtic Name: ethyl 4,5-dimethyl-2-[[3-methyl-1-(4-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[3-methyl-5-oxo-1-(p-tolyl)pyrazol-4-ylidene]methylamino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[3-methyl-1-(4-methylphenyl)-5-oxo-4-pyrazolylidene]methylamino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[3-methyl-1-(4-methylphenyl)-5-oxopyrazol-4-ylidene]methylamino]thiophene-3-carboxylate Traditional Name: 2-[[5-keto-3-methyl-1-(p-tolyl)-2-pyrazolin-4-ylidene]methylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC=C2C(=NN(C2=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC=C2C(=NN(C2=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C21H23N3O3S/c1-6-27-21(26)18-13(3)15(5)28-19(18)22-11-17-14(4)23-24(20(17)25)16-9-7-12(2)8-10-16/h7-11,22H,6H2,1-5H3