3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C10H17N3O3S MolecularWeight: 259.32528

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2CCOCO2

Isomeric SMILES

CCCN1C(=O)NN=C1SC[C@H]2CCOCO2

InChI

InChI=1S/C10H17N3O3S/c1-2-4-13-9(14)11-12-10(13)17-6-8-3-5-15-7-16-8/h8H,2-7H2,1H3,(H,11,14)/t8-/m1/s1