N'-[6-[(3-bromophenyl)amino]-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide

Systemtic Name: N'-[6-[(3-bromophenyl)amino]-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide Openeye Name: N'-[6-(3-bromoanilino)-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide CAS Name: N'-[6-(3-bromoanilino)-5-nitro-4-pyrimidinyl]-4-methylbenzohydrazide IUPAC Name: N'-[6-(3-bromoanilino)-5-nitropyrimidin-4-yl]-4-methylbenzohydrazide Traditional Name: N'-[6-(3-bromoanilino)-5-nitro-pyrimidin-4-yl]-4-methyl-benzohydrazide Formula: C18H15BrN6O3 MolecularWeight: 443.2541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H15BrN6O3/c1-11-5-7-12(8-6-11)18(26)24-23-17-15(25(27)28)16(20-10-21-17)22-14-4-2-3-13(19)9-14/h2-10H,1H3,(H,24,26)(H2,20,21,22,23)