3-piperidin-1-ylsulfonyl-N-[(2,3,4-trimethoxyphenyl)methyl]thiophene-2-carboxamide

Systemtic Name: 3-piperidin-1-ylsulfonyl-N-[(2,3,4-trimethoxyphenyl)methyl]thiophene-2-carboxamide Openeye Name: 3-(1-piperidylsulfonyl)-N-[(2,3,4-trimethoxyphenyl)methyl]thiophene-2-carboxamide CAS Name: 3-(1-piperidinylsulfonyl)-N-[(2,3,4-trimethoxyphenyl)methyl]-2-thiophenecarboxamide IUPAC Name: 3-piperidin-1-ylsulfonyl-N-[(2,3,4-trimethoxyphenyl)methyl]thiophene-2-carboxamide Traditional Name: 3-piperidinosulfonyl-N-(2,3,4-trimethoxybenzyl)thiophene-2-carboxamide Formula: C20H26N2O6S2 MolecularWeight: 454.56024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)OC)OC

InChI

InChI=1S/C20H26N2O6S2/c1-26-15-8-7-14(17(27-2)18(15)28-3)13-21-20(23)19-16(9-12-29-19)30(24,25)22-10-5-4-6-11-22/h7-9,12H,4-6,10-11,13H2,1-3H3,(H,21,23)