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

Systemtic Name: ethyl 4,5-dimethyl-2-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methylamino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methylamino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylamino]thiophene-3-carboxylate Traditional Name: 2-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c1-5-26-20(25)17-12(2)14(4)27-18(17)21-11-16-13(3)22-23(19(16)24)15-9-7-6-8-10-15/h6-11,21H,5H2,1-4H3