5-methyl-2-naphthalen-1-ylsulfanyl-6-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 5-methyl-2-naphthalen-1-ylsulfanyl-6-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 6-benzyl-5-methyl-2-(1-naphthylsulfanyl)-1H-pyrimidin-4-one CAS Name: 5-methyl-2-(1-naphthalenylthio)-6-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 6-benzyl-5-methyl-2-naphthalen-1-ylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-benzyl-5-methyl-2-(1-naphthylthio)-1H-pyrimidin-4-one Formula: C22H18N2OS MolecularWeight: 358.45612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC2=CC=CC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(NC(=NC1=O)SC2=CC=CC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C22H18N2OS/c1-15-19(14-16-8-3-2-4-9-16)23-22(24-21(15)25)26-20-13-7-11-17-10-5-6-12-18(17)20/h2-13H,14H2,1H3,(H,23,24,25)