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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(S2)SCC3=CC=CC=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(S2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C17H14N4S2/c18-10-14-8-4-5-9-15(14)12-22-17-21-20-16(23-17)19-11-13-6-2-1-3-7-13/h1-9H,11-12H2,(H,19,20)