(2R)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propanenitrile

Systemtic Name: (2R)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propanenitrile Openeye Name: (2R)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propanenitrile CAS Name: (2R)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]propanenitrile IUPAC Name: (2R)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propanenitrile Traditional Name: (2R)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]propionitrile Formula: C10H7N3O2S2 MolecularWeight: 265.31148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C#N)SC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H7N3O2S2/c1-6(5-11)16-10-12-8-3-2-7(13(14)15)4-9(8)17-10/h2-4,6H,1H3/t6-/m1/s1