5-(2-hydroxyethylamino)-6-(phenylmethylsulfanyl)-2H-1,2,4-triazin-3-one

Systemtic Name: 5-(2-hydroxyethylamino)-6-(phenylmethylsulfanyl)-2H-1,2,4-triazin-3-one Openeye Name: 6-benzylsulfanyl-5-(2-hydroxyethylamino)-2H-1,2,4-triazin-3-one CAS Name: 5-(2-hydroxyethylamino)-6-(phenylmethylthio)-2H-1,2,4-triazin-3-one IUPAC Name: 6-benzylsulfanyl-5-(2-hydroxyethylamino)-2H-1,2,4-triazin-3-one Traditional Name: 6-(benzylthio)-5-(2-hydroxyethylamino)-2H-1,2,4-triazin-3-one Formula: C12H14N4O2S MolecularWeight: 278.33016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NNC(=O)N=C2NCCO

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NNC(=O)N=C2NCCO

InChI

InChI=1S/C12H14N4O2S/c17-7-6-13-10-11(15-16-12(18)14-10)19-8-9-4-2-1-3-5-9/h1-5,17H,6-8H2,(H2,13,14,16,18)