N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3,5-dimethoxy-benzamide Openeye Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-3,5-dimethoxy-benzamide CAS Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-3,5-dimethoxybenzamide IUPAC Name: N-[2-(4-chlorophenyl)sulfonyl-2-thiophen-2-ylethyl]-3,5-dimethoxybenzamide Traditional Name: N-[2-(4-chlorophenyl)sulfonyl-2-(2-thienyl)ethyl]-3,5-dimethoxy-benzamide Formula: C21H20ClNO5S2 MolecularWeight: 465.9702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C21H20ClNO5S2/c1-27-16-10-14(11-17(12-16)28-2)21(24)23-13-20(19-4-3-9-29-19)30(25,26)18-7-5-15(22)6-8-18/h3-12,20H,13H2,1-2H3,(H,23,24)