6-[(4-chlorophenyl)methyl]-5-methyl-2-(phenylmethoxymethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-[(4-chlorophenyl)methyl]-5-methyl-2-(phenylmethoxymethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2-(benzyloxymethylsulfanyl)-6-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrimidin-4-one CAS Name: 6-[(4-chlorophenyl)methyl]-5-methyl-2-(phenylmethoxymethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[(4-chlorophenyl)methyl]-5-methyl-2-(phenylmethoxymethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 2-(benzoxymethylthio)-6-(4-chlorobenzyl)-5-methyl-1H-pyrimidin-4-one Formula: C20H19ClN2O2S MolecularWeight: 386.89506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCOCC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(NC(=NC1=O)SCOCC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O2S/c1-14-18(11-15-7-9-17(21)10-8-15)22-20(23-19(14)24)26-13-25-12-16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,22,23,24)