N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]-N-methyl-thiophene-2-sulfonamide

Systemtic Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]-N-methyl-thiophene-2-sulfonamide Openeye Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxo-butyl]-N-methyl-thiophene-2-sulfonamide CAS Name: N-[4-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-4-oxobutyl]-N-methyl-2-thiophenesulfonamide IUPAC Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-oxobutyl]-N-methylthiophene-2-sulfonamide Traditional Name: N-[4-[2-(3,4-dimethoxyphenyl)pyrrolidino]-4-keto-butyl]-N-methyl-thiophene-2-sulfonamide Formula: C21H28N2O5S2 MolecularWeight: 452.58742

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N1CCCC1C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCCC(=O)N1CCCC1C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H28N2O5S2/c1-22(30(25,26)21-9-6-14-29-21)12-5-8-20(24)23-13-4-7-17(23)16-10-11-18(27-2)19(15-16)28-3/h6,9-11,14-15,17H,4-5,7-8,12-13H2,1-3H3