N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-(3-cyano-4,5-dimethyl-2-thiophenyl)benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide Traditional Name: 3-(besylmethyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)benzamide Formula: C21H18N2O3S2 MolecularWeight: 410.50922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H18N2O3S2/c1-14-15(2)27-21(19(14)12-22)23-20(24)17-8-6-7-16(11-17)13-28(25,26)18-9-4-3-5-10-18/h3-11H,13H2,1-2H3,(H,23,24)