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

Systemtic Name: 2-[(3,4-dimethylphenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[(3,4-dimethylphenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[(3,4-dimethylphenyl)methylthio]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[(3,4-dimethylphenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[(3,4-dimethylbenzyl)thio]-1,4,5,6-tetrahydropyrimidine Formula: C13H18N2S MolecularWeight: 234.36042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CSC2=NCCCN2)C

Isomeric SMILES

CC1=C(C=C(C=C1)CSC2=NCCCN2)C

InChI

InChI=1S/C13H18N2S/c1-10-4-5-12(8-11(10)2)9-16-13-14-6-3-7-15-13/h4-5,8H,3,6-7,9H2,1-2H3,(H,14,15)