2-[(4-bromophenyl)-(4-methylphenyl)sulfonyl-amino]-N-pyridin-3-yl-ethanamide

Systemtic Name: 2-[(4-bromophenyl)-(4-methylphenyl)sulfonyl-amino]-N-pyridin-3-yl-ethanamide Openeye Name: 2-[4-bromo-N-(p-tolylsulfonyl)anilino]-N-(3-pyridyl)acetamide CAS Name: 2-(4-bromo-N-(4-methylphenyl)sulfonylanilino)-N-(3-pyridinyl)acetamide IUPAC Name: 2-(4-bromo-N-(4-methylphenyl)sulfonylanilino)-N-pyridin-3-ylacetamide Traditional Name: 2-(4-bromo-N-tosyl-anilino)-N-(3-pyridyl)acetamide Formula: C20H18BrN3O3S MolecularWeight: 460.34422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CN=CC=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CN=CC=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H18BrN3O3S/c1-15-4-10-19(11-5-15)28(26,27)24(18-8-6-16(21)7-9-18)14-20(25)23-17-3-2-12-22-13-17/h2-13H,14H2,1H3,(H,23,25)