[2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(3-fluorophenyl)cyclobutane-1-carboxylate

Systemtic Name: [2-[(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(3-fluorophenyl)cyclobutane-1-carboxylate Openeye Name: [2-(2-methyl-5-morpholinosulfonyl-anilino)-2-oxo-ethyl] 1-(3-fluorophenyl)cyclobutanecarboxylate CAS Name: 1-(3-fluorophenyl)-1-cyclobutanecarboxylic acid [2-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 1-(3-fluorophenyl)cyclobutane-1-carboxylate Traditional Name: 1-(3-fluorophenyl)cyclobutanecarboxylic acid [2-keto-2-(2-methyl-5-morpholinosulfonyl-anilino)ethyl] ester Formula: C24H27FN2O6S MolecularWeight: 490.544383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)COC(=O)C3(CCC3)C4=CC(=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)COC(=O)C3(CCC3)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H27FN2O6S/c1-17-6-7-20(34(30,31)27-10-12-32-13-11-27)15-21(17)26-22(28)16-33-23(29)24(8-3-9-24)18-4-2-5-19(25)14-18/h2,4-7,14-15H,3,8-13,16H2,1H3,(H,26,28)