4-(3-methoxypropyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(3-methoxypropyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-(3-methoxypropyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-(3-methoxypropyl)-3-(propylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 4-(3-methoxypropyl)-3-propylsulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-(3-methoxypropyl)-3-(propylthio)-1H-1,2,4-triazol-5-one Formula: C9H17N3O2S MolecularWeight: 231.31518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NNC(=O)N1CCCOC

Isomeric SMILES

CCCSC1=NNC(=O)N1CCCOC

InChI

InChI=1S/C9H17N3O2S/c1-3-7-15-9-11-10-8(13)12(9)5-4-6-14-2/h3-7H2,1-2H3,(H,10,13)