2,4-bis(chloranyl)-N'-[6-(1-methoxypropan-2-ylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2,4-bis(chloranyl)-N'-[6-(1-methoxypropan-2-ylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2,4-dichloro-N'-[6-[(2-methoxy-1-methyl-ethyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2,4-dichloro-N'-[6-(1-methoxypropan-2-ylamino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2,4-dichloro-N'-[6-(1-methoxypropan-2-ylamino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2,4-dichloro-N'-[6-[(2-methoxy-1-methyl-ethyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C15H16Cl2N6O4 MolecularWeight: 415.23134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16Cl2N6O4/c1-8(6-27-2)20-13-12(23(25)26)14(19-7-18-13)21-22-15(24)10-4-3-9(16)5-11(10)17/h3-5,7-8H,6H2,1-2H3,(H,22,24)(H2,18,19,20,21)