3-azanyl-4-nitro-1-benzothiophene-2-carbonitrile

Systemtic Name: 3-azanyl-4-nitro-1-benzothiophene-2-carbonitrile Openeye Name: 3-amino-4-nitro-benzothiophene-2-carbonitrile CAS Name: 3-amino-4-nitro-1-benzothiophene-2-carbonitrile IUPAC Name: 3-amino-4-nitro-1-benzothiophene-2-carbonitrile Traditional Name: 3-amino-4-nitro-benzothiophene-2-carbonitrile Formula: C9H5N3O2S MolecularWeight: 219.2199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC(=C2N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C(=C1)SC(=C2N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C9H5N3O2S/c10-4-7-9(11)8-5(12(13)14)2-1-3-6(8)15-7/h1-3H,11H2