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

Systemtic Name: 3-[[(2R)-oxolan-2-yl]methylsulfanyl]-4-(phenylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-benzyl-3-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 3-[[(2R)-2-oxolanyl]methylthio]-4-(phenylmethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-benzyl-3-[[(2R)-oxolan-2-yl]methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-benzyl-3-[[(2R)-tetrahydrofuran-2-yl]methylthio]-1H-1,2,4-triazol-5-one Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=NNC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](OC1)CSC2=NNC(=O)N2CC3=CC=CC=C3

InChI

InChI=1S/C14H17N3O2S/c18-13-15-16-14(20-10-12-7-4-8-19-12)17(13)9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,15,18)/t12-/m1/s1