ethyl (4S)-2-butylsulfanyl-4-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-2-butylsulfanyl-4-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (4S)-2-butylsulfanyl-4-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: (4S)-2-(butylthio)-4-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-2-butylsulfanyl-4-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: (4S)-2-(butylthio)-4-(4-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H26N2O3S MolecularWeight: 362.48634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(C(=C(N1)C)C(=O)OCC)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCSC1=N[C@H](C(=C(N1)C)C(=O)OCC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H26N2O3S/c1-5-7-12-25-19-20-13(3)16(18(22)24-6-2)17(21-19)14-8-10-15(23-4)11-9-14/h8-11,17H,5-7,12H2,1-4H3,(H,20,21)/t17-/m0/s1