N-[[(2S)-7-chloranyl-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[(2S)-7-chloranyl-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]thiophene-2-carboxamide CAS Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]thiophene-2-carboxamide Traditional Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)coumaran-2-yl]methyl]thiophene-2-carboxamide Formula: C22H20ClNO4S MolecularWeight: 429.9165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC3=C(C(=C2)Cl)OC(C3)CNC(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC3=C(C(=C2)Cl)O[C@@H](C3)CNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H20ClNO4S/c1-26-15-5-6-19(27-2)17(11-15)13-8-14-9-16(28-21(14)18(23)10-13)12-24-22(25)20-4-3-7-29-20/h3-8,10-11,16H,9,12H2,1-2H3,(H,24,25)/t16-/m0/s1