(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-(methylamino)-2-phenyl-ethanoate

Systemtic Name: (2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-(methylamino)-2-phenyl-ethanoate Openeye Name: (2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-(methylamino)-2-phenyl-acetate CAS Name: 2-(methylamino)-2-phenylacetic acid [oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl] ester IUPAC Name: (2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoyl 2-(methylamino)-2-phenylacetate Traditional Name: 2-(methylamino)-2-phenyl-acetic acid (2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoyl ester Formula: C12H12N4O3S2 MolecularWeight: 324.37868

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Descriptors Computed from Structure

Canonical SMILES:

CNC(C1=CC=CC=C1)C(=O)OC(=O)NC2=NNC(=S)S2

Isomeric SMILES

CNC(C1=CC=CC=C1)C(=O)OC(=O)NC2=NNC(=S)S2

InChI

InChI=1S/C12H12N4O3S2/c1-13-8(7-5-3-2-4-6-7)9(17)19-11(18)14-10-15-16-12(20)21-10/h2-6,8,13H,1H3,(H,16,20)(H,14,15,18)