[(4R)-3,3-dimethyl-4-[(4-methylsulfanylphenyl)carbamoyloxy]-4-(4-oxidanylnaphthalen-1-yl)butyl] 2-sulfanylethanoate

Systemtic Name: [(4R)-3,3-dimethyl-4-[(4-methylsulfanylphenyl)carbamoyloxy]-4-(4-oxidanylnaphthalen-1-yl)butyl] 2-sulfanylethanoate Openeye Name: [(4R)-4-(4-hydroxy-1-naphthyl)-3,3-dimethyl-4-[(4-methylsulfanylphenyl)carbamoyloxy]butyl] 2-sulfanylacetate CAS Name: 2-mercaptoacetic acid [(4R)-4-(4-hydroxy-1-naphthalenyl)-3,3-dimethyl-4-[[4-(methylthio)anilino]-oxomethoxy]butyl] ester IUPAC Name: [(4R)-4-(4-hydroxynaphthalen-1-yl)-3,3-dimethyl-4-[(4-methylsulfanylphenyl)carbamoyloxy]butyl] 2-sulfanylacetate Traditional Name: 2-mercaptoacetic acid [(4R)-4-(4-hydroxy-1-naphthyl)-3,3-dimethyl-4-[[4-(methylthio)phenyl]carbamoyloxy]butyl] ester Formula: C26H29NO5S2 MolecularWeight: 499.64216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOC(=O)CS)C(C1=CC=C(C2=CC=CC=C21)O)OC(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)(CCOC(=O)CS)[C@H](C1=CC=C(C2=CC=CC=C21)O)OC(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C26H29NO5S2/c1-26(2,14-15-31-23(29)16-33)24(21-12-13-22(28)20-7-5-4-6-19(20)21)32-25(30)27-17-8-10-18(34-3)11-9-17/h4-13,24,28,33H,14-16H2,1-3H3,(H,27,30)/t24-/m0/s1