4-bromanyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-bromo-N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]benzamide CAS Name: 4-bromo-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-bromo-N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-bromo-N-[2-(2-thienyl)-2-tosyl-ethyl]benzamide Formula: C20H18BrNO3S2 MolecularWeight: 464.39582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC=C(C=C2)Br)C3=CC=CS3

InChI

InChI=1S/C20H18BrNO3S2/c1-14-4-10-17(11-5-14)27(24,25)19(18-3-2-12-26-18)13-22-20(23)15-6-8-16(21)9-7-15/h2-12,19H,13H2,1H3,(H,22,23)