2-bromanyl-N-[2-(4-fluorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-[2-(4-fluorophenyl)sulfonyl-2-thiophen-2-yl-ethyl]-5-methoxy-benzamide Openeye Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-2-(2-thienyl)ethyl]-5-methoxy-benzamide CAS Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-2-thiophen-2-ylethyl]-5-methoxybenzamide IUPAC Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-2-thiophen-2-ylethyl]-5-methoxybenzamide Traditional Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-2-(2-thienyl)ethyl]-5-methoxy-benzamide Formula: C20H17BrFNO4S2 MolecularWeight: 498.385683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)NCC(C2=CC=CS2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H17BrFNO4S2/c1-27-14-6-9-17(21)16(11-14)20(24)23-12-19(18-3-2-10-28-18)29(25,26)15-7-4-13(22)5-8-15/h2-11,19H,12H2,1H3,(H,23,24)