2,3-dimethyl-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]quinoxaline-6-carboxamide

Systemtic Name: 2,3-dimethyl-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]quinoxaline-6-carboxamide Openeye Name: 2,3-dimethyl-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]quinoxaline-6-carboxamide CAS Name: 2,3-dimethyl-N-[4-[(6-phenyl-4-pyrimidinyl)amino]phenyl]-6-quinoxalinecarboxamide IUPAC Name: 2,3-dimethyl-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]quinoxaline-6-carboxamide Traditional Name: 2,3-dimethyl-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]quinoxaline-6-carboxamide Formula: C27H22N6O MolecularWeight: 446.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=NC=NC(=C4)C5=CC=CC=C5)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC4=NC=NC(=C4)C5=CC=CC=C5)N=C1C

InChI

InChI=1S/C27H22N6O/c1-17-18(2)31-25-14-20(8-13-23(25)30-17)27(34)33-22-11-9-21(10-12-22)32-26-15-24(28-16-29-26)19-6-4-3-5-7-19/h3-16H,1-2H3,(H,33,34)(H,28,29,32)