N-[[(2S)-5-(4-methylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[(2S)-5-(4-methylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[[(2S)-5-(4-methylsulfonylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]thiophene-2-carboxamide CAS Name: N-[[(2S)-5-(4-methylsulfonylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[(2S)-5-(4-methylsulfonylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiophene-2-carboxamide Traditional Name: N-[[(2S)-5-(4-mesylphenyl)coumaran-2-yl]methyl]thiophene-2-carboxamide Formula: C21H19NO4S2 MolecularWeight: 413.50986

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(C3)CNC(=O)C4=CC=CS4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC3=C(C=C2)O[C@@H](C3)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C21H19NO4S2/c1-28(24,25)18-7-4-14(5-8-18)15-6-9-19-16(11-15)12-17(26-19)13-22-21(23)20-3-2-10-27-20/h2-11,17H,12-13H2,1H3,(H,22,23)/t17-/m0/s1