2-[[5-[(2-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[5-[(2-methylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[5-(o-toluidino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C17H14N4S2 MolecularWeight: 338.44986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NN=C(S2)SCC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC=CC=C1NC2=NN=C(S2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C17H14N4S2/c1-12-6-2-5-9-15(12)19-16-20-21-17(23-16)22-11-14-8-4-3-7-13(14)10-18/h2-9H,11H2,1H3,(H,19,20)