2-[2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-[(4-methoxyphenyl)methyl]-1H-pyrimidine-6-thione

Systemtic Name: 2-[2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-[(4-methoxyphenyl)methyl]-1H-pyrimidine-6-thione Openeye Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-[(4-methoxyphenyl)methyl]-1H-pyrimidine-6-thione CAS Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethylamino]-5-[(4-methoxyphenyl)methyl]-1H-pyrimidine-6-thione IUPAC Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-[(4-methoxyphenyl)methyl]-1H-pyrimidine-6-thione Traditional Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethylamino]-5-p-anisyl-1H-pyrimidine-6-thione Formula: C18H20BrN5OS2 MolecularWeight: 466.4183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=CN=C(NC2=S)NCCSCC3=C(N=CN3)Br

Isomeric SMILES

COC1=CC=C(C=C1)CC2=CN=C(NC2=S)NCCSCC3=C(N=CN3)Br

InChI

InChI=1S/C18H20BrN5OS2/c1-25-14-4-2-12(3-5-14)8-13-9-21-18(24-17(13)26)20-6-7-27-10-15-16(19)23-11-22-15/h2-5,9,11H,6-8,10H2,1H3,(H,22,23)(H2,20,21,24,26)