ethyl (4S)-6-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-6-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[(5-amino-1,3,4-thiadiazol-2-yl)thio]methyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C12H17N5O3S2 MolecularWeight: 343.42508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CSC2=NN=C(S2)N)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)CSC2=NN=C(S2)N)C(=O)OCC

InChI

InChI=1S/C12H17N5O3S2/c1-3-6-8(9(18)20-4-2)7(15-11(19)14-6)5-21-12-17-16-10(13)22-12/h6H,3-5H2,1-2H3,(H2,13,16)(H2,14,15,19)/t6-/m0/s1