2-[2-[(4-tert-butylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[(4-tert-butylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(4-tert-butylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(4-tert-butylphenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(4-tert-butylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(4-tert-butylbenzyl)thio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2S/c1-21(2,3)17-11-9-16(10-12-17)15-24-19-8-5-4-7-18(19)20-22-13-6-14-23-20/h4-5,7-12H,6,13-15H2,1-3H3,(H,22,23)