ethyl 6-oxidanylidene-5-[2-(phenylsulfonylmethyl)-1,3-thiazol-4-yl]-2-propan-2-yl-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-5-[2-(phenylsulfonylmethyl)-1,3-thiazol-4-yl]-2-propan-2-yl-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-[2-(benzenesulfonylmethyl)thiazol-4-yl]-2-isopropyl-6-oxo-1H-pyridine-3-carboxylate CAS Name: 5-[2-(benzenesulfonylmethyl)-4-thiazolyl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(benzenesulfonylmethyl)-1,3-thiazol-4-yl]-6-oxo-2-propan-2-yl-1H-pyridine-3-carboxylate Traditional Name: 5-[2-(besylmethyl)thiazol-4-yl]-2-isopropyl-6-keto-1H-pyridine-3-carboxylic acid ethyl ester Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)C(=C1)C2=CSC(=N2)CS(=O)(=O)C3=CC=CC=C3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)C(=C1)C2=CSC(=N2)CS(=O)(=O)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C21H22N2O5S2/c1-4-28-21(25)16-10-15(20(24)23-19(16)13(2)3)17-11-29-18(22-17)12-30(26,27)14-8-6-5-7-9-14/h5-11,13H,4,12H2,1-3H3,(H,23,24)