4-[5-[6-[(4-methoxypyridin-2-yl)amino]pyridin-2-yl]-1,3-thiazol-2-yl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[5-[6-[(4-methoxypyridin-2-yl)amino]pyridin-2-yl]-1,3-thiazol-2-yl]cyclohexane-1-carboxylic acid Openeye Name: 4-[5-[6-[(4-methoxy-2-pyridyl)amino]-2-pyridyl]thiazol-2-yl]cyclohexanecarboxylic acid CAS Name: 4-[5-[6-[(4-methoxy-2-pyridinyl)amino]-2-pyridinyl]-2-thiazolyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[5-[6-[(4-methoxypyridin-2-yl)amino]pyridin-2-yl]-1,3-thiazol-2-yl]cyclohexane-1-carboxylic acid Traditional Name: 4-[5-[6-[(4-methoxy-2-pyridyl)amino]-2-pyridyl]thiazol-2-yl]cyclohexanecarboxylic acid Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)NC2=CC=CC(=N2)C3=CN=C(S3)C4CCC(CC4)C(=O)O

Isomeric SMILES

COC1=CC(=NC=C1)NC2=CC=CC(=N2)C3=CN=C(S3)C4CCC(CC4)C(=O)O

InChI

InChI=1S/C21H22N4O3S/c1-28-15-9-10-22-19(11-15)25-18-4-2-3-16(24-18)17-12-23-20(29-17)13-5-7-14(8-6-13)21(26)27/h2-4,9-14H,5-8H2,1H3,(H,26,27)(H,22,24,25)