N'-[6-[bis(phenylmethyl)amino]-5-nitro-pyrimidin-4-yl]-2-fluoranyl-benzohydrazide

Systemtic Name: N'-[6-[bis(phenylmethyl)amino]-5-nitro-pyrimidin-4-yl]-2-fluoranyl-benzohydrazide Openeye Name: N'-[6-(dibenzylamino)-5-nitro-pyrimidin-4-yl]-2-fluoro-benzohydrazide CAS Name: N'-[6-[bis(phenylmethyl)amino]-5-nitro-4-pyrimidinyl]-2-fluorobenzohydrazide IUPAC Name: N'-[6-(dibenzylamino)-5-nitropyrimidin-4-yl]-2-fluorobenzohydrazide Traditional Name: N'-[6-(dibenzylamino)-5-nitro-pyrimidin-4-yl]-2-fluoro-benzohydrazide Formula: C25H21FN6O3 MolecularWeight: 472.471043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NNC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NNC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H21FN6O3/c26-21-14-8-7-13-20(21)25(33)30-29-23-22(32(34)35)24(28-17-27-23)31(15-18-9-3-1-4-10-18)16-19-11-5-2-6-12-19/h1-14,17H,15-16H2,(H,30,33)(H,27,28,29)