2-[2-[(5-bromanyl-2-propan-2-yloxy-phenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[(5-bromanyl-2-propan-2-yloxy-phenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(5-bromo-2-isopropoxy-phenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(5-bromo-2-propan-2-yloxyphenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(5-bromo-2-propan-2-yloxyphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(5-bromo-2-isopropoxy-benzyl)thio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C20H23BrN2OS MolecularWeight: 419.37842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Br)CSC2=CC=CC=C2C3=NCCCN3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Br)CSC2=CC=CC=C2C3=NCCCN3

InChI

InChI=1S/C20H23BrN2OS/c1-14(2)24-18-9-8-16(21)12-15(18)13-25-19-7-4-3-6-17(19)20-22-10-5-11-23-20/h3-4,6-9,12,14H,5,10-11,13H2,1-2H3,(H,22,23)