2-[2-(2-naphthalen-1-ylethylsulfanyl)phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-(2-naphthalen-1-ylethylsulfanyl)phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[2-(1-naphthyl)ethylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[2-(1-naphthalenyl)ethylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-(2-naphthalen-1-ylethylsulfanyl)phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[2-(1-naphthyl)ethylthio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C22H22N2S MolecularWeight: 346.48848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)C2=CC=CC=C2SCCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CNC(=NC1)C2=CC=CC=C2SCCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H22N2S/c1-2-10-19-17(7-1)8-5-9-18(19)13-16-25-21-12-4-3-11-20(21)22-23-14-6-15-24-22/h1-5,7-12H,6,13-16H2,(H,23,24)