N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(phenylsulfonylmethyl)furan-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-3-(phenylsulfonylmethyl)furan-2-carboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]furan-2-carboxamide CAS Name: 3-(benzenesulfonylmethyl)-N-[2-[(3,4-dimethylphenyl)thio]ethyl]-2-furancarboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-[2-(3,4-dimethylphenyl)sulfanylethyl]furan-2-carboxamide Traditional Name: 3-(besylmethyl)-N-[2-[(3,4-dimethylphenyl)thio]ethyl]-2-furamide Formula: C22H23NO4S2 MolecularWeight: 429.55232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNC(=O)C2=C(C=CO2)CS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNC(=O)C2=C(C=CO2)CS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H23NO4S2/c1-16-8-9-19(14-17(16)2)28-13-11-23-22(24)21-18(10-12-27-21)15-29(25,26)20-6-4-3-5-7-20/h3-10,12,14H,11,13,15H2,1-2H3,(H,23,24)