S-(6-nitro-1H-benzimidazol-2-yl) pyrazine-2-carbothioate

Systemtic Name: S-(6-nitro-1H-benzimidazol-2-yl) pyrazine-2-carbothioate Openeye Name: S-(6-nitro-1H-benzimidazol-2-yl) pyrazine-2-carbothioate CAS Name: 2-pyrazinecarbothioic acid S-(6-nitro-1H-benzimidazol-2-yl) ester IUPAC Name: S-(6-nitro-1H-benzimidazol-2-yl) pyrazine-2-carbothioate Traditional Name: pyrazine-2-carbothioic acid S-(6-nitro-1H-benzimidazol-2-yl) ester Formula: C12H7N5O3S MolecularWeight: 301.28068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)SC(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)SC(=O)C3=NC=CN=C3

InChI

InChI=1S/C12H7N5O3S/c18-11(10-6-13-3-4-14-10)21-12-15-8-2-1-7(17(19)20)5-9(8)16-12/h1-6H,(H,15,16)