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

Systemtic Name: N'-[6-[(5-chloranyl-2-methyl-phenyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(5-chloro-2-methyl-anilino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: N'-[6-(5-chloro-2-methylanilino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-(5-chloro-2-methylanilino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: N'-[6-(5-chloro-2-methyl-anilino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C18H15ClN6O3 MolecularWeight: 398.8031

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN6O3/c1-11-7-8-13(19)9-14(11)22-16-15(25(27)28)17(21-10-20-16)23-24-18(26)12-5-3-2-4-6-12/h2-10H,1H3,(H,24,26)(H2,20,21,22,23)