3-(3-azanylpropylsulfanyl)-6-(4-methoxyphenyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 3-(3-azanylpropylsulfanyl)-6-(4-methoxyphenyl)-2H-1,2,4-triazin-5-one Openeye Name: 3-(3-aminopropylsulfanyl)-6-(4-methoxyphenyl)-2H-1,2,4-triazin-5-one CAS Name: 3-(3-aminopropylthio)-6-(4-methoxyphenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 3-(3-aminopropylsulfanyl)-6-(4-methoxyphenyl)-2H-1,2,4-triazin-5-one Traditional Name: 3-(3-aminopropylthio)-6-(4-methoxyphenyl)-2H-1,2,4-triazin-5-one Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=NC2=O)SCCCN

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=NC2=O)SCCCN

InChI

InChI=1S/C13H16N4O2S/c1-19-10-5-3-9(4-6-10)11-12(18)15-13(17-16-11)20-8-2-7-14/h3-6H,2,7-8,14H2,1H3,(H,15,17,18)