3-[(4-chlorophenyl)sulfanylmethyl]-N-(3-methylpyridin-2-yl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N-(3-methylpyridin-2-yl)-1-benzofuran-2-carboxamide Openeye Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N-(3-methyl-2-pyridyl)benzofuran-2-carboxamide CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-N-(3-methyl-2-pyridinyl)-2-benzofurancarboxamide IUPAC Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N-(3-methylpyridin-2-yl)-1-benzofuran-2-carboxamide Traditional Name: 3-[[(4-chlorophenyl)thio]methyl]-N-(3-methyl-2-pyridyl)coumarilamide Formula: C22H17ClN2O2S MolecularWeight: 408.90058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(N=CC=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN2O2S/c1-14-5-4-12-24-21(14)25-22(26)20-18(17-6-2-3-7-19(17)27-20)13-28-16-10-8-15(23)9-11-16/h2-12H,13H2,1H3,(H,24,25,26)