[2-(butylamino)-2-oxidanylidene-ethyl] 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 4-methyl-2-(2-pyridyl)thiazole-5-carboxylate CAS Name: 4-methyl-2-(2-pyridinyl)-5-thiazolecarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-(2-pyridyl)thiazole-5-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=C(N=C(S1)C2=CC=CC=N2)C

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=C(N=C(S1)C2=CC=CC=N2)C

InChI

InChI=1S/C16H19N3O3S/c1-3-4-8-18-13(20)10-22-16(21)14-11(2)19-15(23-14)12-7-5-6-9-17-12/h5-7,9H,3-4,8,10H2,1-2H3,(H,18,20)