N'-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]furan-2-carbohydrazide

Systemtic Name: N'-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-(4-benzylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[5-nitro-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-[6-(4-benzylpiperazino)-5-nitro-pyrimidin-4-yl]-2-furohydrazide Formula: C20H21N7O4 MolecularWeight: 423.42524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N7O4/c28-20(16-7-4-12-31-16)24-23-18-17(27(29)30)19(22-14-21-18)26-10-8-25(9-11-26)13-15-5-2-1-3-6-15/h1-7,12,14H,8-11,13H2,(H,24,28)(H,21,22,23)