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

Systemtic Name: 4-[[5-oxidanylidene-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-oxo-4-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-oxo-4-[[(2R)-2-oxolanyl]methyl]-1H-1,2,4-triazol-3-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-oxo-4-[[(2R)-oxolan-2-yl]methyl]-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[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=C(C=C3)C#N

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=O)NN=C2SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C15H16N4O2S/c16-8-11-3-5-12(6-4-11)10-22-15-18-17-14(20)19(15)9-13-2-1-7-21-13/h3-6,13H,1-2,7,9-10H2,(H,17,20)/t13-/m1/s1