3-nitro-1-(5-nitro-1,3-thiazol-2-yl)pyrazole-4-carbonitrile

Systemtic Name: 3-nitro-1-(5-nitro-1,3-thiazol-2-yl)pyrazole-4-carbonitrile Openeye Name: 3-nitro-1-(5-nitrothiazol-2-yl)pyrazole-4-carbonitrile CAS Name: 3-nitro-1-(5-nitro-2-thiazolyl)-4-pyrazolecarbonitrile IUPAC Name: 3-nitro-1-(5-nitro-1,3-thiazol-2-yl)pyrazole-4-carbonitrile Traditional Name: 3-nitro-1-(5-nitrothiazol-2-yl)pyrazole-4-carbonitrile Formula: C7H2N6O4S MolecularWeight: 266.19358

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=N1)N2C=C(C(=N2)[N+](=O)[O-])C#N)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=N1)N2C=C(C(=N2)[N+](=O)[O-])C#N)[N+](=O)[O-]

InChI

InChI=1S/C7H2N6O4S/c8-1-4-3-11(10-6(4)13(16)17)7-9-2-5(18-7)12(14)15/h2-3H