4-[2-[(3,4-dimethylphenyl)amino]-5-methyl-pyrimidin-4-yl]-N-(2-oxidanyl-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-[(3,4-dimethylphenyl)amino]-5-methyl-pyrimidin-4-yl]-N-(2-oxidanyl-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-(3,4-dimethylanilino)-5-methyl-pyrimidin-4-yl]-N-(2-hydroxy-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide CAS Name: 4-[2-(3,4-dimethylanilino)-5-methyl-4-pyrimidinyl]-N-(2-hydroxy-1-phenylethyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(3,4-dimethylanilino)-5-methylpyrimidin-4-yl]-N-(2-hydroxy-1-phenylethyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-(3,4-dimethylanilino)-5-methyl-pyrimidin-4-yl]-N-(2-hydroxy-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)C3=CNC(=C3)C(=O)NC(CO)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)C3=CNC(=C3)C(=O)NC(CO)C4=CC=CC=C4)C)C

InChI

InChI=1S/C26H27N5O2/c1-16-9-10-21(11-17(16)2)29-26-28-13-18(3)24(31-26)20-12-22(27-14-20)25(33)30-23(15-32)19-7-5-4-6-8-19/h4-14,23,27,32H,15H2,1-3H3,(H,30,33)(H,28,29,31)