4-[2-[(3,5-dimethylphenyl)amino]pyrimidin-4-yl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[2-[(3,5-dimethylphenyl)amino]pyrimidin-4-yl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[2-(3,5-dimethylanilino)pyrimidin-4-yl]thiazole-2-carboxylic acid CAS Name: 4-[2-(3,5-dimethylanilino)-4-pyrimidinyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[2-(3,5-dimethylanilino)pyrimidin-4-yl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[2-(3,5-dimethylanilino)pyrimidin-4-yl]thiazole-2-carboxylic acid Formula: C16H14N4O2S MolecularWeight: 326.37296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CSC(=N3)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CSC(=N3)C(=O)O)C

InChI

InChI=1S/C16H14N4O2S/c1-9-5-10(2)7-11(6-9)18-16-17-4-3-12(20-16)13-8-23-14(19-13)15(21)22/h3-8H,1-2H3,(H,21,22)(H,17,18,20)