3-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-2-naphthalen-1-yl-1,3-thiazolidin-3-yl]ethanoylcarbamoylamino]benzoic acid

Systemtic Name: 3-[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-2-naphthalen-1-yl-1,3-thiazolidin-3-yl]ethanoylcarbamoylamino]benzoic acid Openeye Name: 3-[[2-[4-tert-butoxycarbonyl-2-(1-naphthyl)thiazolidin-3-yl]acetyl]carbamoylamino]benzoic acid CAS Name: 3-[[[[2-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-(1-naphthalenyl)-3-thiazolidinyl]-1-oxoethyl]amino]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-2-naphthalen-1-yl-1,3-thiazolidin-3-yl]acetyl]carbamoylamino]benzoic acid Traditional Name: 3-[[2-[4-tert-butoxycarbonyl-2-(1-naphthyl)thiazolidin-3-yl]acetyl]carbamoylamino]benzoic acid Formula: C28H29N3O6S MolecularWeight: 535.61136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CSC(N1CC(=O)NC(=O)NC2=CC=CC(=C2)C(=O)O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)C1CSC(N1CC(=O)NC(=O)NC2=CC=CC(=C2)C(=O)O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H29N3O6S/c1-28(2,3)37-26(35)22-16-38-24(21-13-7-9-17-8-4-5-12-20(17)21)31(22)15-23(32)30-27(36)29-19-11-6-10-18(14-19)25(33)34/h4-14,22,24H,15-16H2,1-3H3,(H,33,34)(H2,29,30,32,36)