ethyl (5Z)-4-(3,5-dimethylphenyl)-5-(2-sulfanylidenepropylidene)-1,3,4-thiadiazole-2-carboxylate

Systemtic Name: ethyl (5Z)-4-(3,5-dimethylphenyl)-5-(2-sulfanylidenepropylidene)-1,3,4-thiadiazole-2-carboxylate Openeye Name: ethyl (5Z)-4-(3,5-dimethylphenyl)-5-(2-thioxopropylidene)-1,3,4-thiadiazole-2-carboxylate CAS Name: (5Z)-4-(3,5-dimethylphenyl)-5-(2-sulfanylidenepropylidene)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-4-(3,5-dimethylphenyl)-5-(2-sulfanylidenepropylidene)-1,3,4-thiadiazole-2-carboxylate Traditional Name: (5Z)-4-(3,5-dimethylphenyl)-5-(2-thioxopropylidene)-1,3,4-thiadiazole-2-carboxylic acid ethyl ester Formula: C16H18N2O2S2 MolecularWeight: 334.45632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O2S2/c1-5-20-16(19)15-17-18(14(22-15)9-12(4)21)13-7-10(2)6-11(3)8-13/h6-9H,5H2,1-4H3/b14-9-