ethanedioic acid; N-[(2-methoxyphenyl)methyl]-2-(3-phenylsulfanylpropylamino)ethanamide

Systemtic Name: ethanedioic acid; N-[(2-methoxyphenyl)methyl]-2-(3-phenylsulfanylpropylamino)ethanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-2-(3-phenylsulfanylpropylamino)acetamide; oxalic acid CAS Name: N-[(2-methoxyphenyl)methyl]-2-[3-(phenylthio)propylamino]acetamide; oxalic acid IUPAC Name: N-[(2-methoxyphenyl)methyl]-2-(3-phenylsulfanylpropylamino)acetamide; oxalic acid Traditional Name: N-o-anisyl-2-[3-(phenylthio)propylamino]acetamide; oxalic acid Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CNCCCSC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CNCCCSC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H24N2O2S.C2H2O4/c1-23-18-11-6-5-8-16(18)14-21-19(22)15-20-12-7-13-24-17-9-3-2-4-10-17;3-1(4)2(5)6/h2-6,8-11,20H,7,12-15H2,1H3,(H,21,22);(H,3,4)(H,5,6)