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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])C=NNC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])/C=N/NC4=CC=CC=N4

InChI

InChI=1S/C20H16N6O3/c27-26(28)19-10-9-17(29-19)20-16(12-22-23-18-8-4-5-11-21-18)14-25(24-20)13-15-6-2-1-3-7-15/h1-12,14H,13H2,(H,21,23)/b22-12+