N'-[6-(3-methylbutylamino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide

Systemtic Name: N'-[6-(3-methylbutylamino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-ethanehydrazide Openeye Name: N'-[6-(isopentylamino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide CAS Name: N'-[6-(3-methylbutylamino)-5-nitro-4-pyrimidinyl]-2-phenoxyacetohydrazide IUPAC Name: N'-[6-(3-methylbutylamino)-5-nitropyrimidin-4-yl]-2-phenoxyacetohydrazide Traditional Name: N'-[6-(isoamylamino)-5-nitro-pyrimidin-4-yl]-2-phenoxy-acetohydrazide Formula: C17H22N6O4 MolecularWeight: 374.39438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=C(C(=NC=N1)NNC(=O)COC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC1=C(C(=NC=N1)NNC(=O)COC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H22N6O4/c1-12(2)8-9-18-16-15(23(25)26)17(20-11-19-16)22-21-14(24)10-27-13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3,(H,21,24)(H2,18,19,20,22)