[1-(2-ethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: [1-(2-ethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl] 2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxylate Openeye Name: [2-(2-ethyl-1-piperidyl)-1-methyl-2-oxo-ethyl] 2-[(4-methylphenoxy)methyl]thiazole-4-carboxylate CAS Name: 2-[(4-methylphenoxy)methyl]-4-thiazolecarboxylic acid [1-(2-ethyl-1-piperidinyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-ethylpiperidin-1-yl)-1-oxopropan-2-yl] 2-[(4-methylphenoxy)methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(4-methylphenoxy)methyl]thiazole-4-carboxylic acid [2-(2-ethylpiperidino)-2-keto-1-methyl-ethyl] ester Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)OC(=O)C2=CSC(=N2)COC3=CC=C(C=C3)C

Isomeric SMILES

CCC1CCCCN1C(=O)C(C)OC(=O)C2=CSC(=N2)COC3=CC=C(C=C3)C

InChI

InChI=1S/C22H28N2O4S/c1-4-17-7-5-6-12-24(17)21(25)16(3)28-22(26)19-14-29-20(23-19)13-27-18-10-8-15(2)9-11-18/h8-11,14,16-17H,4-7,12-13H2,1-3H3