methyl 2-[2-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]ethylsulfanyl]ethanoate

Systemtic Name: methyl 2-[2-[4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1,3-thiazol-2-yl]ethylsulfanyl]ethanoate Openeye Name: methyl 2-[2-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]ethylsulfanyl]acetate CAS Name: 2-[2-[4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-thiazolyl]ethylthio]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-(3,5-ditert-butyl-4-hydroxyphenyl)-1,3-thiazol-2-yl]ethylsulfanyl]acetate Traditional Name: 2-[2-[4-(3,5-ditert-butyl-4-hydroxy-phenyl)thiazol-2-yl]ethylthio]acetic acid methyl ester Formula: C22H31NO3S2 MolecularWeight: 421.61644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)CCSCC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=CSC(=N2)CCSCC(=O)OC

InChI

InChI=1S/C22H31NO3S2/c1-21(2,3)15-10-14(11-16(20(15)25)22(4,5)6)17-12-28-18(23-17)8-9-27-13-19(24)26-7/h10-12,25H,8-9,13H2,1-7H3