methyl (4R)-4-[2,3-bis(bromanyl)-5-ethoxy-4-propoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-4-[2,3-bis(bromanyl)-5-ethoxy-4-propoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-4-(2,3-dibromo-5-ethoxy-4-propoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(2,3-dibromo-5-ethoxy-4-propoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-4-(2,3-dibromo-5-ethoxy-4-propoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(2,3-dibromo-5-ethoxy-4-propoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C18H22Br2N2O4S MolecularWeight: 522.25128

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1Br)Br)C2C(=C(NC(=S)N2)C)C(=O)OC)OCC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1Br)Br)[C@H]2C(=C(NC(=S)N2)C)C(=O)OC)OCC

InChI

InChI=1S/C18H22Br2N2O4S/c1-5-7-26-16-11(25-6-2)8-10(13(19)14(16)20)15-12(17(23)24-4)9(3)21-18(27)22-15/h8,15H,5-7H2,1-4H3,(H2,21,22,27)/t15-/m0/s1