3-[[5-[[naphthalen-2-ylcarbamoyl-[[2-(trifluoromethyloxy)phenyl]methyl]amino]methyl]thiophen-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-[[naphthalen-2-ylcarbamoyl-[[2-(trifluoromethyloxy)phenyl]methyl]amino]methyl]thiophen-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[5-[[2-naphthylcarbamoyl-[[2-(trifluoromethoxy)phenyl]methyl]amino]methyl]thiophene-2-carbonyl]amino]propanoic acid CAS Name: 3-[[[5-[[[(2-naphthalenylamino)-oxomethyl]-[[2-(trifluoromethoxy)phenyl]methyl]amino]methyl]-2-thiophenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[5-[[naphthalen-2-ylcarbamoyl-[[2-(trifluoromethoxy)phenyl]methyl]amino]methyl]thiophene-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[5-[[2-naphthylcarbamoyl-[2-(trifluoromethoxy)benzyl]amino]methyl]thiophene-2-carbonyl]amino]propionic acid Formula: C28H24F3N3O5S MolecularWeight: 571.56747

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC(=O)N(CC3=CC=CC=C3OC(F)(F)F)CC4=CC=C(S4)C(=O)NCCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=O)N(CC3=CC=CC=C3OC(F)(F)F)CC4=CC=C(S4)C(=O)NCCC(=O)O

InChI

InChI=1S/C28H24F3N3O5S/c29-28(30,31)39-23-8-4-3-7-20(23)16-34(17-22-11-12-24(40-22)26(37)32-14-13-25(35)36)27(38)33-21-10-9-18-5-1-2-6-19(18)15-21/h1-12,15H,13-14,16-17H2,(H,32,37)(H,33,38)(H,35,36)