6-nitro-4-oxidanylidene-1H-[1]benzothiolo[3,2-b]pyridine-3-carbonitrile

Systemtic Name: 6-nitro-4-oxidanylidene-1H-[1]benzothiolo[3,2-b]pyridine-3-carbonitrile Openeye Name: 6-nitro-4-oxo-1H-benzothiopheno[3,2-b]pyridine-3-carbonitrile CAS Name: 6-nitro-4-oxo-1H-[1]benzothiolo[3,2-b]pyridine-3-carbonitrile IUPAC Name: 6-nitro-4-oxo-1H-[1]benzothiolo[3,2-b]pyridine-3-carbonitrile Traditional Name: 4-keto-6-nitro-1H-benzothiopheno[3,2-b]pyridine-3-carbonitrile Formula: C12H5N3O3S MolecularWeight: 271.2514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SC3=C2NC=C(C3=O)C#N

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SC3=C2NC=C(C3=O)C#N

InChI

InChI=1S/C12H5N3O3S/c13-4-6-5-14-9-7-2-1-3-8(15(17)18)11(7)19-12(9)10(6)16/h1-3,5H,(H,14,16)