ethyl 5-ethanoyl-4-methyl-2-[[3-(4-methylphenyl)-1H-pyrazol-5-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-[[3-(4-methylphenyl)-1H-pyrazol-5-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[[3-(p-tolyl)-1H-pyrazole-5-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[[3-(4-methylphenyl)-1H-pyrazol-5-yl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[3-(4-methylphenyl)-1H-pyrazole-5-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[3-(p-tolyl)-1H-pyrazole-5-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H21N3O4S/c1-5-28-21(27)17-12(3)18(13(4)25)29-20(17)22-19(26)16-10-15(23-24-16)14-8-6-11(2)7-9-14/h6-10H,5H2,1-4H3,(H,22,26)(H,23,24)