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

Systemtic Name: 3-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-oxoethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]sulfanyl-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-[(3R,5R)-3,5-dimethylpiperidino]-2-keto-ethyl]thio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C14H24N4O2S MolecularWeight: 312.43096

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)N2CC(CC(C2)C)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)N2C[C@@H](C[C@H](C2)C)C

InChI

InChI=1S/C14H24N4O2S/c1-4-5-18-13(20)15-16-14(18)21-9-12(19)17-7-10(2)6-11(3)8-17/h10-11H,4-9H2,1-3H3,(H,15,20)/t10-,11-/m1/s1