2-chloranyl-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]-4-nitro-benzamide Formula: C23H17ClN6O3 MolecularWeight: 460.87248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC3=NC=CC(=N3)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)NC3=NC=CC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C23H17ClN6O3/c1-14-4-5-16(27-22(31)18-7-6-17(30(32)33)12-19(18)24)11-21(14)29-23-26-10-8-20(28-23)15-3-2-9-25-13-15/h2-13H,1H3,(H,27,31)(H,26,28,29)