[5-[1-[(3,4-dimethoxyphenyl)methyl]-4-oxidanyl-piperidin-4-yl]-1-benzofuran-2-yl]-thiomorpholin-4-yl-methanone

Systemtic Name: [5-[1-[(3,4-dimethoxyphenyl)methyl]-4-oxidanyl-piperidin-4-yl]-1-benzofuran-2-yl]-thiomorpholin-4-yl-methanone Openeye Name: [5-[1-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-4-piperidyl]benzofuran-2-yl]-thiomorpholino-methanone CAS Name: [5-[1-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-4-piperidinyl]-2-benzofuranyl]-thiomorpholin-4-ylmethanone IUPAC Name: [5-[1-[(3,4-dimethoxyphenyl)methyl]-4-hydroxypiperidin-4-yl]-1-benzofuran-2-yl]-thiomorpholin-4-ylmethanone Traditional Name: [5-(4-hydroxy-1-veratryl-4-piperidyl)benzofuran-2-yl]-thiomorpholino-methanone Formula: C27H32N2O5S MolecularWeight: 496.61838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)N5CCSCC5)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)N5CCSCC5)O)OC

InChI

InChI=1S/C27H32N2O5S/c1-32-23-5-3-19(15-24(23)33-2)18-28-9-7-27(31,8-10-28)21-4-6-22-20(16-21)17-25(34-22)26(30)29-11-13-35-14-12-29/h3-6,15-17,31H,7-14,18H2,1-2H3