N-(1,3-benzothiazol-2-ylmethyl)-5-[1-(2-methylpropanoyl)-4-oxidanyl-piperidin-4-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-5-[1-(2-methylpropanoyl)-4-oxidanyl-piperidin-4-yl]-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-5-[4-hydroxy-1-(2-methylpropanoyl)-4-piperidyl]benzofuran-2-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-5-[4-hydroxy-1-(2-methyl-1-oxopropyl)-4-piperidinyl]-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-5-[4-hydroxy-1-(2-methylpropanoyl)piperidin-4-yl]-1-benzofuran-2-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-5-(4-hydroxy-1-isobutyryl-4-piperidyl)coumarilamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)(C2=CC3=C(C=C2)OC(=C3)C(=O)NCC4=NC5=CC=CC=C5S4)O

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)(C2=CC3=C(C=C2)OC(=C3)C(=O)NCC4=NC5=CC=CC=C5S4)O

InChI

InChI=1S/C26H27N3O4S/c1-16(2)25(31)29-11-9-26(32,10-12-29)18-7-8-20-17(13-18)14-21(33-20)24(30)27-15-23-28-19-5-3-4-6-22(19)34-23/h3-8,13-14,16,32H,9-12,15H2,1-2H3,(H,27,30)