1-(4-tert-butyl-2-methyl-phenoxy)-3-[2-(3,4-dimethylphenyl)sulfanylethylamino]propan-2-ol; ethanedioic acid

Systemtic Name: 1-(4-tert-butyl-2-methyl-phenoxy)-3-[2-(3,4-dimethylphenyl)sulfanylethylamino]propan-2-ol; ethanedioic acid Openeye Name: 1-(4-tert-butyl-2-methyl-phenoxy)-3-[2-(3,4-dimethylphenyl)sulfanylethylamino]propan-2-ol; oxalic acid CAS Name: 1-(4-tert-butyl-2-methylphenoxy)-3-[2-[(3,4-dimethylphenyl)thio]ethylamino]-2-propanol; oxalic acid IUPAC Name: 1-(4-tert-butyl-2-methylphenoxy)-3-[2-(3,4-dimethylphenyl)sulfanylethylamino]propan-2-ol; oxalic acid Traditional Name: 1-(4-tert-butyl-2-methyl-phenoxy)-3-[2-[(3,4-dimethylphenyl)thio]ethylamino]propan-2-ol; oxalic acid Formula: C26H37NO6S MolecularWeight: 491.64008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNCC(COC2=C(C=C(C=C2)C(C)(C)C)C)O)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNCC(COC2=C(C=C(C=C2)C(C)(C)C)C)O)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H35NO2S.C2H2O4/c1-17-7-9-22(14-18(17)2)28-12-11-25-15-21(26)16-27-23-10-8-20(13-19(23)3)24(4,5)6;3-1(4)2(5)6/h7-10,13-14,21,25-26H,11-12,15-16H2,1-6H3;(H,3,4)(H,5,6)