4-butyl-3-(2-methoxyethylsulfanyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-butyl-3-(2-methoxyethylsulfanyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-butyl-3-(2-methoxyethylsulfanyl)-1H-1,2,4-triazol-5-one CAS Name: 4-butyl-3-(2-methoxyethylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 4-butyl-3-(2-methoxyethylsulfanyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-butyl-3-(2-methoxyethylthio)-1H-1,2,4-triazol-5-one Formula: C9H17N3O2S MolecularWeight: 231.31518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCCOC

Isomeric SMILES

CCCCN1C(=O)NN=C1SCCOC

InChI

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