2-[3-[(2-cyano-4-nitro-phenyl)amino]propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 2-[3-[(2-cyano-4-nitro-phenyl)amino]propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 2-[3-(2-cyano-4-nitro-anilino)propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 2-[3-(2-cyano-4-nitroanilino)propyl]-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: 2-[3-(2-cyano-4-nitroanilino)propyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 2-[3-(2-cyano-4-nitro-anilino)propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C19H17N7O2 MolecularWeight: 375.38398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(C(=NN12)CCCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C#N)C

Isomeric SMILES

CC1=CC(=NC2=C(C(=NN12)CCCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N)C#N)C

InChI

InChI=1S/C19H17N7O2/c1-12-8-13(2)25-19(23-12)16(11-21)18(24-25)4-3-7-22-17-6-5-15(26(27)28)9-14(17)10-20/h5-6,8-9,22H,3-4,7H2,1-2H3