1-[3-[2-(6-methoxynaphthalen-2-yl)propanoyloxy]propylsulfanylcarbothioyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-[2-(6-methoxynaphthalen-2-yl)propanoyloxy]propylsulfanylcarbothioyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[3-[2-(6-methoxy-2-naphthyl)propanoyloxy]propylsulfanylcarbothioyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[3-[2-(6-methoxy-2-naphthalenyl)-1-oxopropoxy]propylthio]-sulfanylidenemethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-[2-(6-methoxynaphthalen-2-yl)propanoyloxy]propylsulfanylcarbothioyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-[2-(6-methoxy-2-naphthyl)propanoyloxy]propylthio]carbothioylproline Formula: C23H27NO5S2 MolecularWeight: 461.59418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCCSC(=S)N3CCCC3C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCCSC(=S)N3CCCC3C(=O)O

InChI

InChI=1S/C23H27NO5S2/c1-15(16-6-7-18-14-19(28-2)9-8-17(18)13-16)22(27)29-11-4-12-31-23(30)24-10-3-5-20(24)21(25)26/h6-9,13-15,20H,3-5,10-12H2,1-2H3,(H,25,26)