ethyl 4-[2-[(4-fluorophenyl)-(4-methoxyphenyl)sulfonyl-amino]ethanoylamino]-3-methyl-benzoate

Systemtic Name: ethyl 4-[2-[(4-fluorophenyl)-(4-methoxyphenyl)sulfonyl-amino]ethanoylamino]-3-methyl-benzoate Openeye Name: ethyl 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonyl-anilino)acetyl]amino]-3-methyl-benzoate CAS Name: 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)-1-oxoethyl]amino]-3-methylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)acetyl]amino]-3-methylbenzoate Traditional Name: 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonyl-anilino)acetyl]amino]-3-methyl-benzoic acid ethyl ester Formula: C25H25FN2O6S MolecularWeight: 500.539203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C25H25FN2O6S/c1-4-34-25(30)18-5-14-23(17(2)15-18)27-24(29)16-28(20-8-6-19(26)7-9-20)35(31,32)22-12-10-21(33-3)11-13-22/h5-15H,4,16H2,1-3H3,(H,27,29)