4-chloranyl-N'-[6-[(3-methylpyridin-2-yl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide

Systemtic Name: 4-chloranyl-N'-[6-[(3-methylpyridin-2-yl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Openeye Name: 4-chloro-N'-[6-[(3-methyl-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide CAS Name: 4-chloro-N'-[6-[(3-methyl-2-pyridinyl)amino]-5-nitro-4-pyrimidinyl]-3-nitrobenzohydrazide IUPAC Name: 4-chloro-N'-[6-[(3-methylpyridin-2-yl)amino]-5-nitropyrimidin-4-yl]-3-nitrobenzohydrazide Traditional Name: 4-chloro-N'-[6-[(3-methyl-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-3-nitro-benzohydrazide Formula: C17H13ClN8O5 MolecularWeight: 444.78872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H13ClN8O5/c1-9-3-2-6-19-14(9)22-15-13(26(30)31)16(21-8-20-15)23-24-17(27)10-4-5-11(18)12(7-10)25(28)29/h2-8H,1H3,(H,24,27)(H2,19,20,21,22,23)