1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethyl-propan-2-amine; ethanedioate

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethyl-propan-2-amine; ethanedioate Openeye Name: 1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethyl-propan-2-amine; oxalate CAS Name: 1-[2-[(3,4-dimethoxyphenyl)thio]phenyl]-N,N-dimethyl-2-propanamine; oxalate IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)sulfanylphenyl]-N,N-dimethylpropan-2-amine; oxalate Traditional Name: [2-[2-[(3,4-dimethoxyphenyl)thio]phenyl]-1-methyl-ethyl]-dimethyl-amine; oxalate Formula: C21H25NO6S-2 MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1SC2=CC(=C(C=C2)OC)OC)N(C)C.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CC(CC1=CC=CC=C1SC2=CC(=C(C=C2)OC)OC)N(C)C.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C19H25NO2S.C2H2O4/c1-14(20(2)3)12-15-8-6-7-9-19(15)23-16-10-11-17(21-4)18(13-16)22-5;3-1(4)2(5)6/h6-11,13-14H,12H2,1-5H3;(H,3,4)(H,5,6)/p-2