2-[2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidine-6-thione

Systemtic Name: 2-[2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidine-6-thione Openeye Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-(3-pyridylmethyl)-1H-pyrimidine-6-thione CAS Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethylamino]-5-(3-pyridinylmethyl)-1H-pyrimidine-6-thione IUPAC Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidine-6-thione Traditional Name: 2-[2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethylamino]-5-(3-pyridylmethyl)-1H-pyrimidine-6-thione Formula: C16H17BrN6S2 MolecularWeight: 437.38038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17BrN6S2/c17-14-13(21-10-22-14)9-25-5-4-19-16-20-8-12(15(24)23-16)6-11-2-1-3-18-7-11/h1-3,7-8,10H,4-6,9H2,(H,21,22)(H2,19,20,23,24)