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

Systemtic Name: propan-2-yl (4S)-4-(4-bromanylthiophen-2-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isopropyl (4S)-4-(4-bromo-2-thienyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-bromo-2-thiophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (4S)-4-(4-bromothiophen-2-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(4-bromo-2-thienyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isopropyl ester Formula: C13H15BrN2O2S2 MolecularWeight: 375.3044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=CS2)Br)C(=O)OC(C)C

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC(=CS2)Br)C(=O)OC(C)C

InChI

InChI=1S/C13H15BrN2O2S2/c1-6(2)18-12(17)10-7(3)15-13(19)16-11(10)9-4-8(14)5-20-9/h4-6,11H,1-3H3,(H2,15,16,19)/t11-/m1/s1