ethyl (4S)-2-oxidanylidene-4-phenyl-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-2-oxidanylidene-4-phenyl-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-2-oxo-4-phenyl-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-2-oxo-4-phenyl-6-[(1,3,4-thiadiazol-2-ylthio)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-2-oxo-4-phenyl-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-4-phenyl-6-[(1,3,4-thiadiazol-2-ylthio)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H16N4O3S2 MolecularWeight: 376.45324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CSC3=NN=CS3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=CC=C2)CSC3=NN=CS3

InChI

InChI=1S/C16H16N4O3S2/c1-2-23-14(21)12-11(8-24-16-20-17-9-25-16)18-15(22)19-13(12)10-6-4-3-5-7-10/h3-7,9,13H,2,8H2,1H3,(H2,18,19,22)/t13-/m0/s1