2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile

Systemtic Name: 2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile Openeye Name: 2-[[4-(4-chlorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile CAS Name: 2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]propanenitrile IUPAC Name: 2-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]propanenitrile Traditional Name: 2-[[4-(4-chlorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]propionitrile Formula: C11H8ClN3S3 MolecularWeight: 313.84932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN(C(=S)S1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C#N)SC1=NN(C(=S)S1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H8ClN3S3/c1-7(6-13)17-10-14-15(11(16)18-10)9-4-2-8(12)3-5-9/h2-5,7H,1H3