4-[[2-(tert-butylamino)phenyl]amino]-2-phenyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[[2-(tert-butylamino)phenyl]amino]-2-phenyl-pyrimidine-5-carboxylic acid Openeye Name: 4-[2-(tert-butylamino)anilino]-2-phenyl-pyrimidine-5-carboxylic acid CAS Name: 4-[2-(tert-butylamino)anilino]-2-phenyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-[2-(tert-butylamino)anilino]-2-phenylpyrimidine-5-carboxylic acid Traditional Name: 4-[2-(tert-butylamino)anilino]-2-phenyl-pyrimidine-5-carboxylic acid Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=CC=CC=C1NC2=NC(=NC=C2C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC1=CC=CC=C1NC2=NC(=NC=C2C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O2/c1-21(2,3)25-17-12-8-7-11-16(17)23-19-15(20(26)27)13-22-18(24-19)14-9-5-4-6-10-14/h4-13,25H,1-3H3,(H,26,27)(H,22,23,24)