2-(1,3-benzothiazol-2-yl)-2-sulfanyl-propanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-sulfanyl-propanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-sulfanyl-propanenitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-mercaptopropanenitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-sulfanylpropanenitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-mercapto-propionitrile Formula: C10H8N2S2 MolecularWeight: 220.31392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=NC2=CC=CC=C2S1)S

Isomeric SMILES

CC(C#N)(C1=NC2=CC=CC=C2S1)S

InChI

InChI=1S/C10H8N2S2/c1-10(13,6-11)9-12-7-4-2-3-5-8(7)14-9/h2-5,13H,1H3