2-cyclopentylsulfanyl-5-methyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-cyclopentylsulfanyl-5-methyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-cyclopentylsulfanyl-5-methyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one CAS Name: 2-(cyclopentylthio)-5-methyl-6-(1-naphthalenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-cyclopentylsulfanyl-5-methyl-6-(naphthalen-1-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-(cyclopentylthio)-5-methyl-6-(1-naphthylmethyl)-1H-pyrimidin-4-one Formula: C21H22N2OS MolecularWeight: 350.47718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SC2CCCC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=C(NC(=NC1=O)SC2CCCC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H22N2OS/c1-14-19(13-16-9-6-8-15-7-2-5-12-18(15)16)22-21(23-20(14)24)25-17-10-3-4-11-17/h2,5-9,12,17H,3-4,10-11,13H2,1H3,(H,22,23,24)