ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]carbonylimino-3,4-dimethyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidin-4-yl]carbonylimino-3,4-dimethyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]imino-3,4-dimethyl-thiazole-5-carboxylate CAS Name: 2-[[1-(4-fluorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[1-(4-fluorophenyl)sulfonylpiperidine-4-carbonyl]imino-3,4-dimethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[1-(4-fluorophenyl)sulfonylisonipecotoyl]imino-3,4-dimethyl-4-thiazoline-5-carboxylic acid ethyl ester Formula: C20H24FN3O5S2 MolecularWeight: 469.550063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)S1)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)S1)C)C

InChI

InChI=1S/C20H24FN3O5S2/c1-4-29-19(26)17-13(2)23(3)20(30-17)22-18(25)14-9-11-24(12-10-14)31(27,28)16-7-5-15(21)6-8-16/h5-8,14H,4,9-12H2,1-3H3