2-[[1-[(3-naphthalen-2-yl-2-sulfanyl-propanoyl)amino]cyclopentyl]carbonylamino]-3-(4-phenylphenyl)propanoic acid

Systemtic Name: 2-[[1-[(3-naphthalen-2-yl-2-sulfanyl-propanoyl)amino]cyclopentyl]carbonylamino]-3-(4-phenylphenyl)propanoic acid Openeye Name: 2-[[1-[[3-(2-naphthyl)-2-sulfanyl-propanoyl]amino]cyclopentanecarbonyl]amino]-3-(4-phenylphenyl)propanoic acid CAS Name: 2-[[[1-[[2-mercapto-3-(2-naphthalenyl)-1-oxopropyl]amino]cyclopentyl]-oxomethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 2-[[1-[(3-naphthalen-2-yl-2-sulfanylpropanoyl)amino]cyclopentanecarbonyl]amino]-3-(4-phenylphenyl)propanoic acid Traditional Name: 2-[[1-[[2-mercapto-3-(2-naphthyl)propanoyl]amino]cyclopentanecarbonyl]amino]-3-(4-phenylphenyl)propionic acid Formula: C34H34N2O4S MolecularWeight: 566.70976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)NC(=O)C(CC4=CC5=CC=CC=C5C=C4)S

Isomeric SMILES

C1CCC(C1)(C(=O)NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O)NC(=O)C(CC4=CC5=CC=CC=C5C=C4)S

InChI

InChI=1S/C34H34N2O4S/c37-31(30(41)22-24-14-17-26-10-4-5-11-28(26)20-24)36-34(18-6-7-19-34)33(40)35-29(32(38)39)21-23-12-15-27(16-13-23)25-8-2-1-3-9-25/h1-5,8-17,20,29-30,41H,6-7,18-19,21-22H2,(H,35,40)(H,36,37)(H,38,39)