2-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-(4-methylphenyl)propanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C#N)SC2=NN=C(S2)NC

Isomeric SMILES

CC1=CC=C(C=C1)CC(C#N)SC2=NN=C(S2)NC

InChI

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