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

Systemtic Name: prop-2-enyl (4S)-4-(5-bromanylthiophen-2-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: allyl (4S)-4-(5-bromo-2-thienyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(5-bromo-2-thiophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-4-(5-bromothiophen-2-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(5-bromo-2-thienyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid allyl ester Formula: C13H13BrN2O2S2 MolecularWeight: 373.28852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(S2)Br)C(=O)OCC=C

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC=C(S2)Br)C(=O)OCC=C

InChI

InChI=1S/C13H13BrN2O2S2/c1-3-6-18-12(17)10-7(2)15-13(19)16-11(10)8-4-5-9(14)20-8/h3-5,11H,1,6H2,2H3,(H2,15,16,19)/t11-/m1/s1