ethyl 2-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(1,3-diphenylpyrazole-4-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(1,3-diphenyl-4-pyrazolyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1,3-diphenylpyrazole-4-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(1,3-diphenylpyrazole-4-carbonyl)amino]-4,5-dimethyl-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(=C1C)C)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

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