2-bromanyl-N'-[6-[(4-chlorophenyl)methylamino]-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[6-[(4-chlorophenyl)methylamino]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2-bromo-N'-[6-[(4-chlorophenyl)methylamino]-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2-bromo-N'-[6-[(4-chlorophenyl)methylamino]-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-bromo-N'-[6-[(4-chlorophenyl)methylamino]-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2-bromo-N'-[6-[(4-chlorobenzyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C18H14BrClN6O3 MolecularWeight: 477.69916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C18H14BrClN6O3/c19-14-4-2-1-3-13(14)18(27)25-24-17-15(26(28)29)16(22-10-23-17)21-9-11-5-7-12(20)8-6-11/h1-8,10H,9H2,(H,25,27)(H2,21,22,23,24)