methyl 3-[[1-(4-chlorophenyl)-1,2,4-triazol-3-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[1-(4-chlorophenyl)-1,2,4-triazol-3-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[1-(4-chlorophenyl)-1,2,4-triazole-3-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[1-(4-chlorophenyl)-1,2,4-triazol-3-yl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-(4-chlorophenyl)-1,2,4-triazole-3-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[1-(4-chlorophenyl)-1,2,4-triazole-3-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C15H11ClN4O3S MolecularWeight: 362.79084

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2=NN(C=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2=NN(C=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H11ClN4O3S/c1-23-15(22)12-11(6-7-24-12)18-14(21)13-17-8-20(19-13)10-4-2-9(16)3-5-10/h2-8H,1H3,(H,18,21)