2-[2-(4-bromophenyl)sulfanylethylamino]-N-[(2-methoxyphenyl)methyl]ethanamide; ethanedioic acid

Systemtic Name: 2-[2-(4-bromophenyl)sulfanylethylamino]-N-[(2-methoxyphenyl)methyl]ethanamide; ethanedioic acid Openeye Name: 2-[2-(4-bromophenyl)sulfanylethylamino]-N-[(2-methoxyphenyl)methyl]acetamide; oxalic acid CAS Name: 2-[2-[(4-bromophenyl)thio]ethylamino]-N-[(2-methoxyphenyl)methyl]acetamide; oxalic acid IUPAC Name: 2-[2-(4-bromophenyl)sulfanylethylamino]-N-[(2-methoxyphenyl)methyl]acetamide; oxalic acid Traditional Name: 2-[2-[(4-bromophenyl)thio]ethylamino]-N-o-anisyl-acetamide; oxalic acid Formula: C20H23BrN2O6S MolecularWeight: 499.37542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CNCCSC2=CC=C(C=C2)Br.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CNCCSC2=CC=C(C=C2)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H21BrN2O2S.C2H2O4/c1-23-17-5-3-2-4-14(17)12-21-18(22)13-20-10-11-24-16-8-6-15(19)7-9-16;3-1(4)2(5)6/h2-9,20H,10-13H2,1H3,(H,21,22);(H,3,4)(H,5,6)