propan-2-yl 6-methyl-4-(2-pentoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 6-methyl-4-(2-pentoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isopropyl 6-methyl-4-(2-pentoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-(2-pentoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-methyl-4-(2-pentoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(2-amoxyphenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isopropyl ester Formula: C20H28N2O3S MolecularWeight: 376.51292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C2C(=C(NC(=S)N2)C)C(=O)OC(C)C

Isomeric SMILES

CCCCCOC1=CC=CC=C1C2C(=C(NC(=S)N2)C)C(=O)OC(C)C

InChI

InChI=1S/C20H28N2O3S/c1-5-6-9-12-24-16-11-8-7-10-15(16)18-17(19(23)25-13(2)3)14(4)21-20(26)22-18/h7-8,10-11,13,18H,5-6,9,12H2,1-4H3,(H2,21,22,26)