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

Systemtic Name: (2R)-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile Openeye Name: (2R)-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile CAS Name: (2R)-2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]propanenitrile IUPAC Name: (2R)-2-[(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanenitrile Traditional Name: (2R)-2-[[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]thio]propionitrile Formula: C13H11N3OS3 MolecularWeight: 321.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C#N)SC1=NN=C(S1)SCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H11N3OS3/c1-9(7-14)19-13-16-15-12(20-13)18-8-11(17)10-5-3-2-4-6-10/h2-6,9H,8H2,1H3/t9-/m1/s1