methyl 2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(5-cyclopropyl-2-phenyl-3-pyrazolyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-cyclopropyl-2-phenylpyrazole-3-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4)C

InChI

InChI=1S/C21H21N3O3S/c1-12-13(2)28-20(18(12)21(26)27-3)22-19(25)17-11-16(14-9-10-14)23-24(17)15-7-5-4-6-8-15/h4-8,11,14H,9-10H2,1-3H3,(H,22,25)