2-[2,3-bis(phenylcarbonylsulfanyl)propanoylamino]-3-naphthalen-1-yl-propanoic acid

Systemtic Name: 2-[2,3-bis(phenylcarbonylsulfanyl)propanoylamino]-3-naphthalen-1-yl-propanoic acid Openeye Name: 2-[2,3-bis(benzoylsulfanyl)propanoylamino]-3-(1-naphthyl)propanoic acid CAS Name: 2-[[2,3-bis(benzoylthio)-1-oxopropyl]amino]-3-(1-naphthalenyl)propanoic acid IUPAC Name: 2-[2,3-bis(benzoylsulfanyl)propanoylamino]-3-naphthalen-1-ylpropanoic acid Traditional Name: 2-[2,3-bis(benzoylthio)propanoylamino]-3-(1-naphthyl)propionic acid Formula: C30H25NO5S2 MolecularWeight: 543.6532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCC(C(=O)NC(CC2=CC=CC3=CC=CC=C32)C(=O)O)SC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCC(C(=O)NC(CC2=CC=CC3=CC=CC=C32)C(=O)O)SC(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H25NO5S2/c32-27(31-25(28(33)34)18-23-16-9-15-20-10-7-8-17-24(20)23)26(38-30(36)22-13-5-2-6-14-22)19-37-29(35)21-11-3-1-4-12-21/h1-17,25-26H,18-19H2,(H,31,32)(H,33,34)