2,4-bis(chloranyl)-N'-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2,4-bis(chloranyl)-N'-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2,4-dichloro-N'-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2,4-dichloro-N'-[6-(cyclopentylamino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2,4-dichloro-N'-[6-(cyclopentylamino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2,4-dichloro-N'-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C16H16Cl2N6O3 MolecularWeight: 411.24264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=C(C(=NC=N2)NNC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)NC2=C(C(=NC=N2)NNC(=O)C3=C(C=C(C=C3)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H16Cl2N6O3/c17-9-5-6-11(12(18)7-9)16(25)23-22-15-13(24(26)27)14(19-8-20-15)21-10-3-1-2-4-10/h5-8,10H,1-4H2,(H,23,25)(H2,19,20,21,22)