[2-[(2,3-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate

Systemtic Name: [2-[(2,3-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate Openeye Name: [2-(N-acetyl-2,3-dimethyl-anilino)thiazol-4-yl]methyl 6-morpholinopyridine-3-carboxylate CAS Name: 6-(4-morpholinyl)-3-pyridinecarboxylic acid [2-(N-acetyl-2,3-dimethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2,3-dimethylanilino)-1,3-thiazol-4-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate Traditional Name: 6-morpholinonicotinic acid [2-(N-acetyl-2,3-dimethyl-anilino)thiazol-4-yl]methyl ester Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=CN=C(C=C3)N4CCOCC4)C(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=CN=C(C=C3)N4CCOCC4)C(=O)C)C

InChI

InChI=1S/C24H26N4O4S/c1-16-5-4-6-21(17(16)2)28(18(3)29)24-26-20(15-33-24)14-32-23(30)19-7-8-22(25-13-19)27-9-11-31-12-10-27/h4-8,13,15H,9-12,14H2,1-3H3