methyl 5-(4-chlorophenyl)-3-[(2,5-dimethylpyrazol-3-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-3-[(2,5-dimethylpyrazol-3-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-3-[(2,5-dimethylpyrazole-3-carbonyl)amino]thiophene-2-carboxylate CAS Name: 5-(4-chlorophenyl)-3-[[(2,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-3-[(2,5-dimethylpyrazole-3-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-(4-chlorophenyl)-3-[(2,5-dimethylpyrazole-3-carbonyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)OC)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)OC)C

InChI

InChI=1S/C18H16ClN3O3S/c1-10-8-14(22(2)21-10)17(23)20-13-9-15(26-16(13)18(24)25-3)11-4-6-12(19)7-5-11/h4-9H,1-3H3,(H,20,23)