ethyl 2-[2-[phenyl-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[phenyl-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-(N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)anilino)acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-(N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)anilino)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)anilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)anilino)acetyl]amino]benzoic acid ethyl ester Formula: C19H18N4O3S2 MolecularWeight: 414.50122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=CC=C2)C3=NNC(=S)S3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=CC=C2)C3=NNC(=S)S3

InChI

InChI=1S/C19H18N4O3S2/c1-2-26-17(25)14-10-6-7-11-15(14)20-16(24)12-23(13-8-4-3-5-9-13)18-21-22-19(27)28-18/h3-11H,2,12H2,1H3,(H,20,24)(H,22,27)