N'-[6-[2-(3,4-dimethoxyphenyl)ethylamino]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide

Systemtic Name: N'-[6-[2-(3,4-dimethoxyphenyl)ethylamino]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-[2-(3,4-dimethoxyphenyl)ethylamino]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[6-[2-(3,4-dimethoxyphenyl)ethylamino]-5-nitro-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[6-[2-(3,4-dimethoxyphenyl)ethylamino]-5-nitropyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-[6-(homoveratrylamino)-5-nitro-pyrimidin-4-yl]-2-furohydrazide Formula: C19H20N6O6 MolecularWeight: 428.3987

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20N6O6/c1-29-13-6-5-12(10-15(13)30-2)7-8-20-17-16(25(27)28)18(22-11-21-17)23-24-19(26)14-4-3-9-31-14/h3-6,9-11H,7-8H2,1-2H3,(H,24,26)(H2,20,21,22,23)