methyl (4S)-4-(4-bromanylthiophen-2-yl)-6-ethyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-4-(4-bromanylthiophen-2-yl)-6-ethyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-4-(4-bromo-2-thienyl)-6-ethyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-bromo-2-thiophenyl)-6-ethyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(4-bromothiophen-2-yl)-6-ethyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(4-bromo-2-thienyl)-6-ethyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C12H13BrN2O2S2 MolecularWeight: 361.27782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(NC(=S)N1)C2=CC(=CS2)Br)C(=O)OC

Isomeric SMILES

CCC1=C([C@H](NC(=S)N1)C2=CC(=CS2)Br)C(=O)OC

InChI

InChI=1S/C12H13BrN2O2S2/c1-3-7-9(11(16)17-2)10(15-12(18)14-7)8-4-6(13)5-19-8/h4-5,10H,3H2,1-2H3,(H2,14,15,18)/t10-/m1/s1