2-[2-[(4-methylnaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[(4-methylnaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(4-methyl-1-naphthyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(4-methyl-1-naphthalenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(4-methylnaphthalen-1-yl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(4-methyl-1-naphthyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C22H22N2S MolecularWeight: 346.48848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=CC=CC=C12)CSC3=CC=CC=C3C4=NCCCN4

Isomeric SMILES

CC1=CC=C(C2=CC=CC=C12)CSC3=CC=CC=C3C4=NCCCN4

InChI

InChI=1S/C22H22N2S/c1-16-11-12-17(19-8-3-2-7-18(16)19)15-25-21-10-5-4-9-20(21)22-23-13-6-14-24-22/h2-5,7-12H,6,13-15H2,1H3,(H,23,24)