2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetonitrile CAS Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]acetonitrile IUPAC Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetonitrile Traditional Name: 2-[[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]thio]acetonitrile Formula: C12H12N4S2 MolecularWeight: 276.38048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NN=C(S2)SCC#N

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NN=C(S2)SCC#N

InChI

InChI=1S/C12H12N4S2/c13-7-9-17-12-16-15-11(18-12)14-8-6-10-4-2-1-3-5-10/h1-5H,6,8-9H2,(H,14,15)