2-(butylamino)-5-nitro-thiophene-3-carbonitrile

Systemtic Name: 2-(butylamino)-5-nitro-thiophene-3-carbonitrile Openeye Name: 2-(butylamino)-5-nitro-thiophene-3-carbonitrile CAS Name: 2-(butylamino)-5-nitro-3-thiophenecarbonitrile IUPAC Name: 2-(butylamino)-5-nitrothiophene-3-carbonitrile Traditional Name: 2-(butylamino)-5-nitro-thiophene-3-carbonitrile Formula: C9H11N3O2S MolecularWeight: 225.26754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(S1)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCNC1=C(C=C(S1)[N+](=O)[O-])C#N

InChI

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