3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(3-methyl-1-piperidinyl)-2-oxoethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(3-methylpiperidino)ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C13H22N4O2S MolecularWeight: 298.40438

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)N2CCCC(C2)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)N2CCCC(C2)C

InChI

InChI=1S/C13H22N4O2S/c1-3-6-17-12(19)14-15-13(17)20-9-11(18)16-7-4-5-10(2)8-16/h10H,3-9H2,1-2H3,(H,14,19)