2-[[5-ethoxycarbonyl-6-methyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidin-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-ethoxycarbonyl-6-methyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidin-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-ethoxycarbonyl-6-methyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidin-2-yl]sulfanyl]acetic acid CAS Name: 2-[[5-ethoxycarbonyl-6-methyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidin-2-yl]thio]acetic acid IUPAC Name: 2-[[5-ethoxycarbonyl-6-methyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidin-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-carbethoxy-6-methyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidin-2-yl]thio]acetic acid Formula: C19H24N2O7S MolecularWeight: 424.46806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=CC(=C(C(=C2)OC)OC)OC)SCC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=CC(=C(C(=C2)OC)OC)OC)SCC(=O)O)C

InChI

InChI=1S/C19H24N2O7S/c1-6-28-18(24)15-10(2)20-19(29-9-14(22)23)21-16(15)11-7-12(25-3)17(27-5)13(8-11)26-4/h7-8,16H,6,9H2,1-5H3,(H,20,21)(H,22,23)