N-[4-(aminomethyl)phenyl]sulfonyl-4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methyl-furan-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-[4-(aminomethyl)phenyl]sulfonyl-4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methyl-furan-2-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-[4-(aminomethyl)phenyl]sulfonyl-4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methyl-furan-2-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: N-[4-(aminomethyl)phenyl]sulfonyl-4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methyl-2-furancarboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-[4-(aminomethyl)phenyl]sulfonyl-4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methylfuran-2-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: N-[4-(aminomethyl)phenyl]sulfonyl-4-[[4-(4-methoxyphenyl)phenoxy]methyl]-5-methyl-2-furamide; 2,2,2-trifluoroacetic acid Formula: C29H27F3N2O8S MolecularWeight: 620.59349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)CN)COC3=CC=C(C=C3)C4=CC=C(C=C4)OC.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=C(C=C(O1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)CN)COC3=CC=C(C=C3)C4=CC=C(C=C4)OC.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C27H26N2O6S.C2HF3O2/c1-18-22(17-34-24-11-7-21(8-12-24)20-5-9-23(33-2)10-6-20)15-26(35-18)27(30)29-36(31,32)25-13-3-19(16-28)4-14-25;3-2(4,5)1(6)7/h3-15H,16-17,28H2,1-2H3,(H,29,30);(H,6,7)