4-(butylamino)-5-nitro-thiophene-2-carbonitrile

Systemtic Name: 4-(butylamino)-5-nitro-thiophene-2-carbonitrile Openeye Name: 4-(butylamino)-5-nitro-thiophene-2-carbonitrile CAS Name: 4-(butylamino)-5-nitro-2-thiophenecarbonitrile IUPAC Name: 4-(butylamino)-5-nitrothiophene-2-carbonitrile Traditional Name: 4-(butylamino)-5-nitro-thiophene-2-carbonitrile Formula: C9H11N3O2S MolecularWeight: 225.26754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(SC(=C1)C#N)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(SC(=C1)C#N)[N+](=O)[O-]

InChI

InChI=1S/C9H11N3O2S/c1-2-3-4-11-8-5-7(6-10)15-9(8)12(13)14/h5,11H,2-4H2,1H3