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

Systemtic Name: 2-[4-bromanyl-2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[4-bromo-2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[4-bromo-2-[(5-bromo-2-methoxyphenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[4-bromo-2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[4-bromo-2-[(5-bromo-2-methoxy-benzyl)thio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C18H18Br2N2OS MolecularWeight: 470.22132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC(=C2)Br)C3=NCCCN3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC(=C2)Br)C3=NCCCN3

InChI

InChI=1S/C18H18Br2N2OS/c1-23-16-6-4-13(19)9-12(16)11-24-17-10-14(20)3-5-15(17)18-21-7-2-8-22-18/h3-6,9-10H,2,7-8,11H2,1H3,(H,21,22)