2-[4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]benzonitrile CAS Name: 2-[4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]phenyl]benzonitrile Traditional Name: 2-[4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]phenyl]benzonitrile Formula: C17H13N3S3 MolecularWeight: 355.50022

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(S1)SCC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CSC1=NN=C(S1)SCC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C17H13N3S3/c1-21-16-19-20-17(23-16)22-11-12-6-8-13(9-7-12)15-5-3-2-4-14(15)10-18/h2-9H,11H2,1H3