N-[(E)-[1-(4-methylphenyl)-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino]pyridin-3-amine

Systemtic Name: N-[(E)-[1-(4-methylphenyl)-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino]pyridin-3-amine Openeye Name: N-[(E)-[3-(5-nitro-2-furyl)-1-(p-tolyl)pyrazol-4-yl]methyleneamino]pyridin-3-amine CAS Name: N-[(E)-[1-(4-methylphenyl)-3-(5-nitro-2-furanyl)-4-pyrazolyl]methylideneamino]-3-pyridinamine IUPAC Name: N-[(E)-[1-(4-methylphenyl)-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino]pyridin-3-amine Traditional Name: [(E)-[3-(5-nitro-2-furyl)-1-(p-tolyl)pyrazol-4-yl]methyleneamino]-(3-pyridyl)amine Formula: C20H16N6O3 MolecularWeight: 388.37944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])C=NNC4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])/C=N/NC4=CN=CC=C4

InChI

InChI=1S/C20H16N6O3/c1-14-4-6-17(7-5-14)25-13-15(11-22-23-16-3-2-10-21-12-16)20(24-25)18-8-9-19(29-18)26(27)28/h2-13,23H,1H3/b22-11+