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

Systemtic Name: 2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanenitrile Openeye Name: 2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetonitrile CAS Name: 2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]acetonitrile IUPAC Name: 2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetonitrile Traditional Name: 2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]acetonitrile Formula: C12H9N3OS3 MolecularWeight: 307.41436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)SCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)SCC#N

InChI

InChI=1S/C12H9N3OS3/c13-6-7-17-11-14-15-12(19-11)18-8-10(16)9-4-2-1-3-5-9/h1-5H,7-8H2