3-(5-chloranyl-2-sulfanylidene-1,3-benzothiazol-3-yl)propanenitrile

Systemtic Name: 3-(5-chloranyl-2-sulfanylidene-1,3-benzothiazol-3-yl)propanenitrile Openeye Name: 3-(5-chloro-2-thioxo-1,3-benzothiazol-3-yl)propanenitrile CAS Name: 3-(5-chloro-2-sulfanylidene-1,3-benzothiazol-3-yl)propanenitrile IUPAC Name: 3-(5-chloro-2-sulfanylidene-1,3-benzothiazol-3-yl)propanenitrile Traditional Name: 3-(5-chloro-2-thioxo-1,3-benzothiazol-3-yl)propionitrile Formula: C10H7ClN2S2 MolecularWeight: 254.75898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N(C(=S)S2)CCC#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)N(C(=S)S2)CCC#N

InChI

InChI=1S/C10H7ClN2S2/c11-7-2-3-9-8(6-7)13(5-1-4-12)10(14)15-9/h2-3,6H,1,5H2