3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-(2-ethylphenyl)benzamide

Systemtic Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-(2-ethylphenyl)benzamide Openeye Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-(2-ethylphenyl)benzamide CAS Name: 3-[[4-(4-acetamidophenyl)-2-pyrimidinyl]amino]-N-(2-ethylphenyl)benzamide IUPAC Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-(2-ethylphenyl)benzamide Traditional Name: 3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]-N-(2-ethylphenyl)benzamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC(=CC=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C27H25N5O2/c1-3-19-7-4-5-10-24(19)31-26(34)21-8-6-9-23(17-21)30-27-28-16-15-25(32-27)20-11-13-22(14-12-20)29-18(2)33/h4-17H,3H2,1-2H3,(H,29,33)(H,31,34)(H,28,30,32)