3-[(4-chlorophenyl)sulfanylmethyl]-N-(2,3-dihydro-1H-inden-5-yl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N-(2,3-dihydro-1H-inden-5-yl)-1-benzofuran-2-carboxamide Openeye Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N-indan-5-yl-benzofuran-2-carboxamide CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-N-(2,3-dihydro-1H-inden-5-yl)-2-benzofurancarboxamide IUPAC Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N-(2,3-dihydro-1H-inden-5-yl)-1-benzofuran-2-carboxamide Traditional Name: 3-[[(4-chlorophenyl)thio]methyl]-N-indan-5-yl-coumarilamide Formula: C25H20ClNO2S MolecularWeight: 433.9498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4O3)CSC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H20ClNO2S/c26-18-9-12-20(13-10-18)30-15-22-21-6-1-2-7-23(21)29-24(22)25(28)27-19-11-8-16-4-3-5-17(16)14-19/h1-2,6-14H,3-5,15H2,(H,27,28)