5-[(4-methoxyphenyl)methyl]-2-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidine-6-thione

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-2-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidine-6-thione Openeye Name: 5-[(4-methoxyphenyl)methyl]-2-[2-(2-pyridylmethylsulfanyl)ethylamino]-1H-pyrimidine-6-thione CAS Name: 5-[(4-methoxyphenyl)methyl]-2-[2-(2-pyridinylmethylthio)ethylamino]-1H-pyrimidine-6-thione IUPAC Name: 5-[(4-methoxyphenyl)methyl]-2-[2-(pyridin-2-ylmethylsulfanyl)ethylamino]-1H-pyrimidine-6-thione Traditional Name: 5-p-anisyl-2-[2-(2-pyridylmethylthio)ethylamino]-1H-pyrimidine-6-thione Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=CN=C(NC2=S)NCCSCC3=CC=CC=N3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=CN=C(NC2=S)NCCSCC3=CC=CC=N3

InChI

InChI=1S/C20H22N4OS2/c1-25-18-7-5-15(6-8-18)12-16-13-23-20(24-19(16)26)22-10-11-27-14-17-4-2-3-9-21-17/h2-9,13H,10-12,14H2,1H3,(H2,22,23,24,26)