[2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 1-ethanoylpiperidine-4-carboxylate

Systemtic Name: [2-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]methyl 1-ethanoylpiperidine-4-carboxylate Openeye Name: [2-[2-(2-methylanilino)-2-oxo-ethyl]thiazol-4-yl]methyl 1-acetylpiperidine-4-carboxylate CAS Name: 1-acetyl-4-piperidinecarboxylic acid [2-[2-(2-methylanilino)-2-oxoethyl]-4-thiazolyl]methyl ester IUPAC Name: [2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl 1-acetylpiperidine-4-carboxylate Traditional Name: 1-acetylisonipecotic acid [2-[2-keto-2-(o-toluidino)ethyl]thiazol-4-yl]methyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)COC(=O)C3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)COC(=O)C3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H25N3O4S/c1-14-5-3-4-6-18(14)23-19(26)11-20-22-17(13-29-20)12-28-21(27)16-7-9-24(10-8-16)15(2)25/h3-6,13,16H,7-12H2,1-2H3,(H,23,26)