(2E)-2-(3-propyl-1,3-benzothiazol-2-ylidene)-3-sulfanyl-propanenitrile

Systemtic Name: (2E)-2-(3-propyl-1,3-benzothiazol-2-ylidene)-3-sulfanyl-propanenitrile Openeye Name: (2E)-2-(3-propyl-1,3-benzothiazol-2-ylidene)-3-sulfanyl-propanenitrile CAS Name: (2E)-3-mercapto-2-(3-propyl-1,3-benzothiazol-2-ylidene)propanenitrile IUPAC Name: (2E)-2-(3-propyl-1,3-benzothiazol-2-ylidene)-3-sulfanylpropanenitrile Traditional Name: (2E)-3-mercapto-2-(3-propyl-1,3-benzothiazol-2-ylidene)propionitrile Formula: C13H14N2S2 MolecularWeight: 262.39366

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2SC1=C(CS)C#N

Isomeric SMILES

CCCN\1C2=CC=CC=C2S/C1=C(/CS)\C#N

InChI

InChI=1S/C13H14N2S2/c1-2-7-15-11-5-3-4-6-12(11)17-13(15)10(8-14)9-16/h3-6,16H,2,7,9H2,1H3/b13-10+