4-[2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]thio]ethoxy]benzonitrile Formula: C12H12N4OS2 MolecularWeight: 292.37988

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NN=C(S1)SCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CNC1=NN=C(S1)SCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C12H12N4OS2/c1-14-11-15-16-12(19-11)18-7-6-17-10-4-2-9(8-13)3-5-10/h2-5H,6-7H2,1H3,(H,14,15)