ethyl 5-[2-[2-(butylamino)pyridin-4-yl]-1,3-thiazol-4-yl]-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-[2-[2-(butylamino)pyridin-4-yl]-1,3-thiazol-4-yl]-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-[2-[2-(butylamino)-4-pyridyl]thiazol-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxylate CAS Name: 5-[2-[2-(butylamino)-4-pyridinyl]-4-thiazolyl]-2-methyl-6-oxo-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[2-(butylamino)pyridin-4-yl]-1,3-thiazol-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-[2-[2-(butylamino)-4-pyridyl]thiazol-4-yl]-6-keto-2-methyl-1H-pyridine-3-carboxylic acid ethyl ester Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=CC(=C1)C2=NC(=CS2)C3=CC(=C(NC3=O)C)C(=O)OCC

Isomeric SMILES

CCCCNC1=NC=CC(=C1)C2=NC(=CS2)C3=CC(=C(NC3=O)C)C(=O)OCC

InChI

InChI=1S/C21H24N4O3S/c1-4-6-8-22-18-10-14(7-9-23-18)20-25-17(12-29-20)16-11-15(21(27)28-5-2)13(3)24-19(16)26/h7,9-12H,4-6,8H2,1-3H3,(H,22,23)(H,24,26)