methyl (4S)-4-[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-4-[4-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-4-[4-[2-(dimethylamino)-2-oxo-ethoxy]-3-ethoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-[4-[2-(dimethylamino)-2-oxoethoxy]-3-ethoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-[4-[2-(dimethylamino)-2-oxoethoxy]-3-ethoxyphenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-[4-[2-(dimethylamino)-2-keto-ethoxy]-3-ethoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)OC)OCC(=O)N(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@H]2C(=C(NC(=S)N2)C)C(=O)OC)OCC(=O)N(C)C

InChI

InChI=1S/C19H25N3O5S/c1-6-26-14-9-12(7-8-13(14)27-10-15(23)22(3)4)17-16(18(24)25-5)11(2)20-19(28)21-17/h7-9,17H,6,10H2,1-5H3,(H2,20,21,28)/t17-/m0/s1