2-[2-[(3,4-dimethylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[(3,4-dimethylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(3,4-dimethylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(3,4-dimethylphenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(3,4-dimethylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(3,4-dimethylbenzyl)thio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C19H22N2S MolecularWeight: 310.45638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CSC2=CC=CC=C2C3=NCCCN3)C

Isomeric SMILES

CC1=C(C=C(C=C1)CSC2=CC=CC=C2C3=NCCCN3)C

InChI

InChI=1S/C19H22N2S/c1-14-8-9-16(12-15(14)2)13-22-18-7-4-3-6-17(18)19-20-10-5-11-21-19/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H,20,21)