4-tert-butyl-2-[[6-(1-phenylethylcarbamoylamino)pyridin-2-yl]carbonylamino]benzoic acid

Systemtic Name: 4-tert-butyl-2-[[6-(1-phenylethylcarbamoylamino)pyridin-2-yl]carbonylamino]benzoic acid Openeye Name: 4-tert-butyl-2-[[6-(1-phenylethylcarbamoylamino)pyridine-2-carbonyl]amino]benzoic acid CAS Name: 4-tert-butyl-2-[[oxo-[6-[[oxo-(1-phenylethylamino)methyl]amino]-2-pyridinyl]methyl]amino]benzoic acid IUPAC Name: 4-tert-butyl-2-[[6-(1-phenylethylcarbamoylamino)pyridine-2-carbonyl]amino]benzoic acid Traditional Name: 4-tert-butyl-2-[[6-(1-phenylethylcarbamoylamino)picolinoyl]amino]benzoic acid Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)NC2=CC=CC(=N2)C(=O)NC3=C(C=CC(=C3)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)NC2=CC=CC(=N2)C(=O)NC3=C(C=CC(=C3)C(C)(C)C)C(=O)O

InChI

InChI=1S/C26H28N4O4/c1-16(17-9-6-5-7-10-17)27-25(34)30-22-12-8-11-20(28-22)23(31)29-21-15-18(26(2,3)4)13-14-19(21)24(32)33/h5-16H,1-4H3,(H,29,31)(H,32,33)(H2,27,28,30,34)