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

Systemtic Name: 4-[[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C18H12N4S3 MolecularWeight: 380.50968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)C#N

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)C#N

InChI

InChI=1S/C18H12N4S3/c19-9-13-1-5-15(6-2-13)11-23-17-21-22-18(25-17)24-12-16-7-3-14(10-20)4-8-16/h1-8H,11-12H2