methyl 4-[(E)-2-(5-acetamido-1,3,4-thiadiazol-2-yl)-2-cyano-ethenyl]benzoate

Systemtic Name: methyl 4-[(E)-2-(5-acetamido-1,3,4-thiadiazol-2-yl)-2-cyano-ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-(5-acetamido-1,3,4-thiadiazol-2-yl)-2-cyano-vinyl]benzoate CAS Name: 4-[(E)-2-(5-acetamido-1,3,4-thiadiazol-2-yl)-2-cyanoethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-(5-acetamido-1,3,4-thiadiazol-2-yl)-2-cyanoethenyl]benzoate Traditional Name: 4-[(E)-2-(5-acetamido-1,3,4-thiadiazol-2-yl)-2-cyano-vinyl]benzoic acid methyl ester Formula: C15H12N4O3S MolecularWeight: 328.34578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(S1)C(=CC2=CC=C(C=C2)C(=O)OC)C#N

Isomeric SMILES

CC(=O)NC1=NN=C(S1)/C(=C/C2=CC=C(C=C2)C(=O)OC)/C#N

InChI

InChI=1S/C15H12N4O3S/c1-9(20)17-15-19-18-13(23-15)12(8-16)7-10-3-5-11(6-4-10)14(21)22-2/h3-7H,1-2H3,(H,17,19,20)/b12-7+