methyl 2-[(4S)-4-(5-bromanylthiophen-2-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[(4S)-4-(5-bromanylthiophen-2-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[(4S)-4-(5-bromo-2-thienyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxo-acetate CAS Name: 2-[(4S)-4-(5-bromo-2-thiophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[(4S)-4-(5-bromothiophen-2-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxoacetate Traditional Name: 2-[(4S)-4-(5-bromo-2-thienyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-keto-acetic acid methyl ester Formula: C12H11BrN2O3S2 MolecularWeight: 375.26134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11BrN2O3S2/c1-5-8(10(16)11(17)18-2)9(15-12(19)14-5)6-3-4-7(13)20-6/h3-4,9H,1-2H3,(H2,14,15,19)/t9-/m1/s1