methyl 3-[4-(2,4-dichlorophenyl)carbonyl-5-methyl-1,2,3-triazol-1-yl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[4-(2,4-dichlorophenyl)carbonyl-5-methyl-1,2,3-triazol-1-yl]thiophene-2-carboxylate Openeye Name: methyl 3-[4-(2,4-dichlorobenzoyl)-5-methyl-triazol-1-yl]thiophene-2-carboxylate CAS Name: 3-[4-[(2,4-dichlorophenyl)-oxomethyl]-5-methyl-1-triazolyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(2,4-dichlorobenzoyl)-5-methyltriazol-1-yl]thiophene-2-carboxylate Traditional Name: 3-[4-(2,4-dichlorobenzoyl)-5-methyl-triazol-1-yl]thiophene-2-carboxylic acid methyl ester Formula: C16H11Cl2N3O3S MolecularWeight: 396.24784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=C(SC=C2)C(=O)OC)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(N=NN1C2=C(SC=C2)C(=O)OC)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H11Cl2N3O3S/c1-8-13(14(22)10-4-3-9(17)7-11(10)18)19-20-21(8)12-5-6-25-15(12)16(23)24-2/h3-7H,1-2H3