2-[[2-azanyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-6-bromanyl-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxy-benzoic acid

Systemtic Name: 2-[[2-azanyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-6-bromanyl-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxy-benzoic acid Openeye Name: 2-[[2-amino-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-6-bromo-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxy-benzoic acid CAS Name: 2-[[[2-amino-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]thio]methyl]-6-bromo-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxybenzoic acid IUPAC Name: 2-[[2-amino-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]sulfanylmethyl]-6-bromo-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxybenzoic acid Traditional Name: 2-[[[2-amino-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]thio]methyl]-6-bromo-3-[tert-butyl(dimethyl)silyl]oxy-5-methoxy-benzoic acid Formula: C20H30BrN3O5SSi MolecularWeight: 532.5238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C(CSCC2=C(C(=C(C=C2O[Si](C)(C)C(C)(C)C)OC)Br)C(=O)O)N

Isomeric SMILES

CC1=NOC(=N1)C(CSCC2=C(C(=C(C=C2O[Si](C)(C)C(C)(C)C)OC)Br)C(=O)O)N

InChI

InChI=1S/C20H30BrN3O5SSi/c1-11-23-18(28-24-11)13(22)10-30-9-12-14(29-31(6,7)20(2,3)4)8-15(27-5)17(21)16(12)19(25)26/h8,13H,9-10,22H2,1-7H3,(H,25,26)