2-[[5-oxidanylidene-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[5-oxidanylidene-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[5-oxo-4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[5-oxo-4-[[(2R)-2-oxolanyl]methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[5-oxo-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[5-keto-4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]benzonitrile Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)NN=C2SCC3=CC=CC=C3C#N

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=O)NN=C2SCC3=CC=CC=C3C#N

InChI

InChI=1S/C15H16N4O2S/c16-8-11-4-1-2-5-12(11)10-22-15-18-17-14(20)19(15)9-13-6-3-7-21-13/h1-2,4-5,13H,3,6-7,9-10H2,(H,17,20)/t13-/m1/s1