methyl (4R)-4-(7-bromanyl-1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-4-(7-bromanyl-1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-4-(7-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(7-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-4-(7-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(7-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C14H13BrN2O4S MolecularWeight: 385.23302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC3=C(C(=C2)Br)OCO3)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC3=C(C(=C2)Br)OCO3)C(=O)OC

InChI

InChI=1S/C14H13BrN2O4S/c1-6-10(13(18)19-2)11(17-14(22)16-6)7-3-8(15)12-9(4-7)20-5-21-12/h3-4,11H,5H2,1-2H3,(H2,16,17,22)/t11-/m1/s1