ethyl 2-methyl-5-phenyl-3H-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: ethyl 2-methyl-5-phenyl-3H-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl 2-methyl-5-phenyl-3H-1,3,4-thiadiazole-2-carboxylate CAS Name: 2-methyl-5-phenyl-3H-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-phenyl-3H-1,3,4-thiadiazole-2-carboxylate Traditional Name: 2-methyl-5-phenyl-3H-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(NN=C(S1)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1(NN=C(S1)C2=CC=CC=C2)C

InChI

InChI=1S/C12H14N2O2S/c1-3-16-11(15)12(2)14-13-10(17-12)9-7-5-4-6-8-9/h4-8,14H,3H2,1-2H3