3-(3-oxidanylidenebutan-2-ylsulfanyl)-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(3-oxidanylidenebutan-2-ylsulfanyl)-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-(1-methyl-2-oxo-propyl)sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-(3-oxobutan-2-ylthio)-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-(3-oxobutan-2-ylsulfanyl)-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[(2-keto-1-methyl-propyl)thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C9H15N3O2S MolecularWeight: 229.2993

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SC(C)C(=O)C

Isomeric SMILES

CCCN1C(=O)NN=C1SC(C)C(=O)C

InChI

InChI=1S/C9H15N3O2S/c1-4-5-12-8(14)10-11-9(12)15-7(3)6(2)13/h7H,4-5H2,1-3H3,(H,10,14)