N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2,6-dimethyl-benzamide

Systemtic Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2,6-dimethyl-benzamide Openeye Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2,6-dimethyl-benzamide CAS Name: N-[3-[[4-(4-acetamidophenyl)-2-pyrimidinyl]amino]phenyl]-2,6-dimethylbenzamide IUPAC Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2,6-dimethylbenzamide Traditional Name: N-[3-[[4-(4-acetamidophenyl)pyrimidin-2-yl]amino]phenyl]-2,6-dimethyl-benzamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)NC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)NC2=CC=CC(=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)NC(=O)C

InChI

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