N'-[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]-2,2-diphenyl-ethanehydrazide

Systemtic Name: N'-[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]-2,2-diphenyl-ethanehydrazide Openeye Name: N'-[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide CAS Name: N'-[5-nitro-6-(propan-2-ylamino)-4-pyrimidinyl]-2,2-diphenylacetohydrazide IUPAC Name: N'-[5-nitro-6-(propan-2-ylamino)pyrimidin-4-yl]-2,2-diphenylacetohydrazide Traditional Name: N'-[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=C(C(=NC=N1)NNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1=C(C(=NC=N1)NNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O3/c1-14(2)24-19-18(27(29)30)20(23-13-22-19)25-26-21(28)17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-14,17H,1-2H3,(H,26,28)(H2,22,23,24,25)