ethyl 4,5-dimethyl-2-[(2-phenyl-1,2,3-triazol-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[(2-phenyl-1,2,3-triazol-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[(2-phenyltriazole-4-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[oxo-(2-phenyl-4-triazolyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[(2-phenyltriazole-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[(2-phenyltriazole-4-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O3S/c1-4-25-18(24)15-11(2)12(3)26-17(15)20-16(23)14-10-19-22(21-14)13-8-6-5-7-9-13/h5-10H,4H2,1-3H3,(H,20,23)