N-[2-(4-dimethylaminophenyl)-2-(phenylsulfonyl)ethyl]-5-ethyl-thiophene-2-sulfonamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-(phenylsulfonyl)ethyl]-5-ethyl-thiophene-2-sulfonamide Openeye Name: N-[2-(benzenesulfonyl)-2-(4-dimethylaminophenyl)ethyl]-5-ethyl-thiophene-2-sulfonamide CAS Name: N-[2-(benzenesulfonyl)-2-(4-dimethylaminophenyl)ethyl]-5-ethyl-2-thiophenesulfonamide IUPAC Name: N-[2-(benzenesulfonyl)-2-(4-dimethylaminophenyl)ethyl]-5-ethylthiophene-2-sulfonamide Traditional Name: N-[2-besyl-2-(4-dimethylaminophenyl)ethyl]-5-ethyl-thiophene-2-sulfonamide Formula: C22H26N2O4S3 MolecularWeight: 478.64784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(S1)S(=O)(=O)NCC(C2=CC=C(C=C2)N(C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S3/c1-4-19-14-15-22(29-19)31(27,28)23-16-21(17-10-12-18(13-11-17)24(2)3)30(25,26)20-8-6-5-7-9-20/h5-15,21,23H,4,16H2,1-3H3