4-(4-ethoxyphenyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-ethoxyphenyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-ethoxyphenyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-ethoxyphenyl)-3-[(2-pyrimidinylthio)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-ethoxyphenyl)-3-(pyrimidin-2-ylsulfanylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-p-phenetyl-3-[(2-pyrimidylthio)methyl]-1H-1,2,4-triazole-5-thione Formula: C15H15N5OS2 MolecularWeight: 345.4425

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC=CC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC=CC=N3

InChI

InChI=1S/C15H15N5OS2/c1-2-21-12-6-4-11(5-7-12)20-13(18-19-15(20)22)10-23-14-16-8-3-9-17-14/h3-9H,2,10H2,1H3,(H,19,22)