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

Systemtic Name: 2-[2-[(3,5-dimethoxyphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(3,5-dimethoxyphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(3,5-dimethoxyphenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(3,5-dimethoxyphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(3,5-dimethoxybenzyl)thio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CSC2=CC=CC=C2C3=NCCCN3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CSC2=CC=CC=C2C3=NCCCN3)OC

InChI

InChI=1S/C19H22N2O2S/c1-22-15-10-14(11-16(12-15)23-2)13-24-18-7-4-3-6-17(18)19-20-8-5-9-21-19/h3-4,6-7,10-12H,5,8-9,13H2,1-2H3,(H,20,21)