3-azanyl-5-[3-[(5-nitropyridin-2-yl)amino]propyl]-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-[3-[(5-nitropyridin-2-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Openeye Name: 3-amino-5-[3-[(5-nitro-2-pyridyl)amino]propyl]-1H-pyrazole-4-carbonitrile CAS Name: 3-amino-5-[3-[(5-nitro-2-pyridinyl)amino]propyl]-1H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-5-[3-[(5-nitropyridin-2-yl)amino]propyl]-1H-pyrazole-4-carbonitrile Traditional Name: 3-amino-5-[3-[(5-nitro-2-pyridyl)amino]propyl]-1H-pyrazole-4-carbonitrile Formula: C12H13N7O2 MolecularWeight: 287.27732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1[N+](=O)[O-])NCCCC2=C(C(=NN2)N)C#N

Isomeric SMILES

C1=CC(=NC=C1[N+](=O)[O-])NCCCC2=C(C(=NN2)N)C#N

InChI

InChI=1S/C12H13N7O2/c13-6-9-10(17-18-12(9)14)2-1-5-15-11-4-3-8(7-16-11)19(20)21/h3-4,7H,1-2,5H2,(H,15,16)(H3,14,17,18)