4-chloranyl-N'-[6-[(4-methylpiperazin-1-yl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-chloranyl-N'-[6-[(4-methylpiperazin-1-yl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 4-chloro-N'-[6-[(4-methylpiperazin-1-yl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 4-chloro-N'-[6-[(4-methyl-1-piperazinyl)amino]-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-chloro-N'-[6-[(4-methylpiperazin-1-yl)amino]-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 4-chloro-N'-[6-[(4-methylpiperazino)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C16H19ClN8O3 MolecularWeight: 406.82686

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H19ClN8O3/c1-23-6-8-24(9-7-23)22-15-13(25(27)28)14(18-10-19-15)20-21-16(26)11-2-4-12(17)5-3-11/h2-5,10H,6-9H2,1H3,(H,21,26)(H2,18,19,20,22)