4-chloranyl-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl]-3-nitro-benzamide Formula: C24H18ClN5O3 MolecularWeight: 459.88442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H18ClN5O3/c1-15-26-21(16-5-3-2-4-6-16)14-23(27-15)28-18-8-10-19(11-9-18)29-24(31)17-7-12-20(25)22(13-17)30(32)33/h2-14H,1H3,(H,29,31)(H,26,27,28)