N-(4-acetamido-3-methyl-phenyl)-3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(4-acetamido-3-methyl-phenyl)-3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxamide Openeye Name: N-(4-acetamido-3-methyl-phenyl)-3-[(4-chlorophenyl)sulfanylmethyl]benzofuran-2-carboxamide CAS Name: N-(4-acetamido-3-methylphenyl)-3-[[(4-chlorophenyl)thio]methyl]-2-benzofurancarboxamide IUPAC Name: N-(4-acetamido-3-methylphenyl)-3-[(4-chlorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxamide Traditional Name: N-(4-acetamido-3-methyl-phenyl)-3-[[(4-chlorophenyl)thio]methyl]coumarilamide Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21ClN2O3S/c1-15-13-18(9-12-22(15)27-16(2)29)28-25(30)24-21(20-5-3-4-6-23(20)31-24)14-32-19-10-7-17(26)8-11-19/h3-13H,14H2,1-2H3,(H,27,29)(H,28,30)