2-ethylsulfanyl-3,6-dimethyl-5-[(2-methylphenyl)methyl]pyrimidin-4-one

Systemtic Name: 2-ethylsulfanyl-3,6-dimethyl-5-[(2-methylphenyl)methyl]pyrimidin-4-one Openeye Name: 2-ethylsulfanyl-3,6-dimethyl-5-(o-tolylmethyl)pyrimidin-4-one CAS Name: 2-(ethylthio)-3,6-dimethyl-5-[(2-methylphenyl)methyl]-4-pyrimidinone IUPAC Name: 2-ethylsulfanyl-3,6-dimethyl-5-[(2-methylphenyl)methyl]pyrimidin-4-one Traditional Name: 2-(ethylthio)-3,6-dimethyl-5-(2-methylbenzyl)pyrimidin-4-one Formula: C16H20N2OS MolecularWeight: 288.4078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=C(C(=O)N1C)CC2=CC=CC=C2C)C

Isomeric SMILES

CCSC1=NC(=C(C(=O)N1C)CC2=CC=CC=C2C)C

InChI

InChI=1S/C16H20N2OS/c1-5-20-16-17-12(3)14(15(19)18(16)4)10-13-9-7-6-8-11(13)2/h6-9H,5,10H2,1-4H3