ethyl 6-phenyl-2-propylsulfanyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-phenyl-2-propylsulfanyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-phenyl-2-propylsulfanyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 6-phenyl-2-(propylthio)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-phenyl-2-propylsulfanyl-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 6-phenyl-2-(propylthio)-4-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(C(=C(N1)C2=CC=CC=C2)C(=O)OCC)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCCSC1=NC(C(=C(N1)C2=CC=CC=C2)C(=O)OCC)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C25H30N2O5S/c1-6-13-33-25-26-21(16-11-9-8-10-12-16)20(24(28)32-7-2)22(27-25)17-14-18(29-3)23(31-5)19(15-17)30-4/h8-12,14-15,22H,6-7,13H2,1-5H3,(H,26,27)