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

Systemtic Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 2-[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[5-(cyclopropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C13H12N4S2 MolecularWeight: 288.39118

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NN=C(S2)SCC3=CC=CC=C3C#N

Isomeric SMILES

C1CC1NC2=NN=C(S2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C13H12N4S2/c14-7-9-3-1-2-4-10(9)8-18-13-17-16-12(19-13)15-11-5-6-11/h1-4,11H,5-6,8H2,(H,15,16)