2-[4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)phenyl]benzenecarbonitrile Openeye Name: 2-[4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)phenyl]benzonitrile CAS Name: 2-[4-[(1,3,4-thiadiazol-2-ylthio)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)phenyl]benzonitrile Traditional Name: 2-[4-[(1,3,4-thiadiazol-2-ylthio)methyl]phenyl]benzonitrile Formula: C16H11N3S2 MolecularWeight: 309.40864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CSC3=NN=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CSC3=NN=CS3

InChI

InChI=1S/C16H11N3S2/c17-9-14-3-1-2-4-15(14)13-7-5-12(6-8-13)10-20-16-19-18-11-21-16/h1-8,11H,10H2