3-[[5-[(2,3-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile

Systemtic Name: 3-[[5-[(2,3-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile Openeye Name: 3-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile CAS Name: 3-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]propanenitrile IUPAC Name: 3-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile Traditional Name: 3-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]propionitrile Formula: C13H14N4S2 MolecularWeight: 290.40706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=NN=C(S2)SCCC#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=NN=C(S2)SCCC#N)C

InChI

InChI=1S/C13H14N4S2/c1-9-5-3-6-11(10(9)2)15-12-16-17-13(19-12)18-8-4-7-14/h3,5-6H,4,8H2,1-2H3,(H,15,16)