4-methoxy-2-methyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-one

Systemtic Name: 4-methoxy-2-methyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-one Openeye Name: 5-allylsulfanyl-4-methoxy-2-methyl-1,2,4-triazol-3-one CAS Name: 4-methoxy-2-methyl-5-(prop-2-enylthio)-1,2,4-triazol-3-one IUPAC Name: 4-methoxy-2-methyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-one Traditional Name: 5-(allylthio)-4-methoxy-2-methyl-1,2,4-triazol-3-one Formula: C7H11N3O2S MolecularWeight: 201.24614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=N1)SCC=C)OC

Isomeric SMILES

CN1C(=O)N(C(=N1)SCC=C)OC

InChI

InChI=1S/C7H11N3O2S/c1-4-5-13-6-8-9(2)7(11)10(6)12-3/h4H,1,5H2,2-3H3