4-[2-oxidanyl-3-(1,3,4-thiadiazol-2-ylsulfanyl)propoxy]benzenecarbonitrile

Systemtic Name: 4-[2-oxidanyl-3-(1,3,4-thiadiazol-2-ylsulfanyl)propoxy]benzenecarbonitrile Openeye Name: 4-[2-hydroxy-3-(1,3,4-thiadiazol-2-ylsulfanyl)propoxy]benzonitrile CAS Name: 4-[2-hydroxy-3-(1,3,4-thiadiazol-2-ylthio)propoxy]benzonitrile IUPAC Name: 4-[2-hydroxy-3-(1,3,4-thiadiazol-2-ylsulfanyl)propoxy]benzonitrile Traditional Name: 4-[2-hydroxy-3-(1,3,4-thiadiazol-2-ylthio)propoxy]benzonitrile Formula: C12H11N3O2S2 MolecularWeight: 293.36464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCC(CSC2=NN=CS2)O

Isomeric SMILES

C1=CC(=CC=C1C#N)OCC(CSC2=NN=CS2)O

InChI

InChI=1S/C12H11N3O2S2/c13-5-9-1-3-11(4-2-9)17-6-10(16)7-18-12-15-14-8-19-12/h1-4,8,10,16H,6-7H2