5-methyl-1-[1-(4-methylphenyl)sulfanyl-3-phenylmethoxy-propyl]pyrimidine-2,4-dione

Systemtic Name: 5-methyl-1-[1-(4-methylphenyl)sulfanyl-3-phenylmethoxy-propyl]pyrimidine-2,4-dione Openeye Name: 1-[3-benzyloxy-1-(p-tolylsulfanyl)propyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 5-methyl-1-[1-[(4-methylphenyl)thio]-3-phenylmethoxypropyl]pyrimidine-2,4-dione IUPAC Name: 5-methyl-1-[1-(4-methylphenyl)sulfanyl-3-phenylmethoxypropyl]pyrimidine-2,4-dione Traditional Name: 1-[3-benzoxy-1-(p-tolylthio)propyl]-5-methyl-pyrimidine-2,4-quinone Formula: C22H24N2O3S MolecularWeight: 396.50256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CCOCC2=CC=CC=C2)N3C=C(C(=O)NC3=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(CCOCC2=CC=CC=C2)N3C=C(C(=O)NC3=O)C

InChI

InChI=1S/C22H24N2O3S/c1-16-8-10-19(11-9-16)28-20(24-14-17(2)21(25)23-22(24)26)12-13-27-15-18-6-4-3-5-7-18/h3-11,14,20H,12-13,15H2,1-2H3,(H,23,25,26)