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

Systemtic Name: N'-[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]-2-phenoxy-ethanehydrazide Openeye Name: N'-[6-(4-isopropylanilino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide CAS Name: N'-[5-nitro-6-(4-propan-2-ylanilino)-4-pyrimidinyl]-2-phenoxyacetohydrazide IUPAC Name: N'-[5-nitro-6-(4-propan-2-ylanilino)pyrimidin-4-yl]-2-phenoxyacetohydrazide Traditional Name: N'-(6-cumidino-5-nitro-pyrimidin-4-yl)-2-phenoxy-acetohydrazide Formula: C21H22N6O4 MolecularWeight: 422.43718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)COC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)COC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O4/c1-14(2)15-8-10-16(11-9-15)24-20-19(27(29)30)21(23-13-22-20)26-25-18(28)12-31-17-6-4-3-5-7-17/h3-11,13-14H,12H2,1-2H3,(H,25,28)(H2,22,23,24,26)