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

Systemtic Name: N-[[(2S)-7-chloranyl-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-thiophen-3-yl-ethanamide Openeye Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-(3-thienyl)acetamide CAS Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-(3-thiophenyl)acetamide IUPAC Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-thiophen-3-ylacetamide Traditional Name: N-[[(2S)-7-chloro-5-(2,5-dimethoxyphenyl)coumaran-2-yl]methyl]-2-(3-thienyl)acetamide Formula: C23H22ClNO4S MolecularWeight: 443.94308

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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)CC4=CSC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC3=C(C(=C2)Cl)O[C@@H](C3)CNC(=O)CC4=CSC=C4

InChI

InChI=1S/C23H22ClNO4S/c1-27-17-3-4-21(28-2)19(11-17)15-8-16-9-18(29-23(16)20(24)10-15)12-25-22(26)7-14-5-6-30-13-14/h3-6,8,10-11,13,18H,7,9,12H2,1-2H3,(H,25,26)/t18-/m0/s1