phenyl 3-ethoxy-4-methyl-5-sulfanylidene-1,2,4-triazole-1-carboxylate

Systemtic Name: phenyl 3-ethoxy-4-methyl-5-sulfanylidene-1,2,4-triazole-1-carboxylate Openeye Name: phenyl 3-ethoxy-4-methyl-5-thioxo-1,2,4-triazole-1-carboxylate CAS Name: 3-ethoxy-4-methyl-5-sulfanylidene-1,2,4-triazole-1-carboxylic acid phenyl ester IUPAC Name: phenyl 3-ethoxy-4-methyl-5-sulfanylidene-1,2,4-triazole-1-carboxylate Traditional Name: 3-ethoxy-4-methyl-5-thioxo-1,2,4-triazole-1-carboxylic acid phenyl ester Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=S)N1C)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCOC1=NN(C(=S)N1C)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C12H13N3O3S/c1-3-17-10-13-15(11(19)14(10)2)12(16)18-9-7-5-4-6-8-9/h4-8H,3H2,1-2H3