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

Systemtic Name: N'-[6-(butan-2-ylamino)-5-nitro-pyrimidin-4-yl]-2,4-bis(chloranyl)benzohydrazide Openeye Name: 2,4-dichloro-N'-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]benzohydrazide CAS Name: N'-[6-(butan-2-ylamino)-5-nitro-4-pyrimidinyl]-2,4-dichlorobenzohydrazide IUPAC Name: N'-[6-(butan-2-ylamino)-5-nitropyrimidin-4-yl]-2,4-dichlorobenzohydrazide Traditional Name: 2,4-dichloro-N'-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]benzohydrazide Formula: C15H16Cl2N6O3 MolecularWeight: 399.23194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=NC=N1)NNC(=O)C2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C(C(=NC=N1)NNC(=O)C2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H16Cl2N6O3/c1-3-8(2)20-13-12(23(25)26)14(19-7-18-13)21-22-15(24)10-5-4-9(16)6-11(10)17/h4-8H,3H2,1-2H3,(H,22,24)(H2,18,19,20,21)