N'-[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]benzohydrazide

Systemtic Name: N'-[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(4-isopropylanilino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: N'-[5-nitro-6-(4-propan-2-ylanilino)-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[5-nitro-6-(4-propan-2-ylanilino)pyrimidin-4-yl]benzohydrazide Traditional Name: N'-(6-cumidino-5-nitro-pyrimidin-4-yl)benzohydrazide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O3/c1-13(2)14-8-10-16(11-9-14)23-18-17(26(28)29)19(22-12-21-18)24-25-20(27)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,25,27)(H2,21,22,23,24)