4-[1-(1-adamantylcarbonyl)piperidin-4-yl]-N-[2-oxidanyl-3-(1-thiophen-2-ylsulfonylindol-4-yl)oxy-propyl]-N-propan-2-yl-piperidine-1-carboxamide

Systemtic Name: 4-[1-(1-adamantylcarbonyl)piperidin-4-yl]-N-[2-oxidanyl-3-(1-thiophen-2-ylsulfonylindol-4-yl)oxy-propyl]-N-propan-2-yl-piperidine-1-carboxamide Openeye Name: 4-[1-(adamantane-1-carbonyl)-4-piperidyl]-N-[2-hydroxy-3-[1-(2-thienylsulfonyl)indol-4-yl]oxy-propyl]-N-isopropyl-piperidine-1-carboxamide CAS Name: 4-[1-[1-adamantyl(oxo)methyl]-4-piperidinyl]-N-[2-hydroxy-3-[(1-thiophen-2-ylsulfonyl-4-indolyl)oxy]propyl]-N-propan-2-yl-1-piperidinecarboxamide IUPAC Name: 4-[1-(adamantane-1-carbonyl)piperidin-4-yl]-N-[2-hydroxy-3-(1-thiophen-2-ylsulfonylindol-4-yl)oxypropyl]-N-propan-2-ylpiperidine-1-carboxamide Traditional Name: 4-[1-(adamantane-1-carbonyl)-4-piperidyl]-N-[2-hydroxy-3-[1-(2-thienylsulfonyl)indol-4-yl]oxy-propyl]-N-isopropyl-piperidine-1-carboxamide Formula: C40H54N4O6S2 MolecularWeight: 751.00996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(COC1=CC=CC2=C1C=CN2S(=O)(=O)C3=CC=CS3)O)C(=O)N4CCC(CC4)C5CCN(CC5)C(=O)C67CC8CC(C6)CC(C8)C7

Isomeric SMILES

CC(C)N(CC(COC1=CC=CC2=C1C=CN2S(=O)(=O)C3=CC=CS3)O)C(=O)N4CCC(CC4)C5CCN(CC5)C(=O)C67CC8CC(C6)CC(C8)C7

InChI

InChI=1S/C40H54N4O6S2/c1-27(2)43(25-33(45)26-50-36-6-3-5-35-34(36)12-17-44(35)52(48,49)37-7-4-18-51-37)39(47)42-15-10-32(11-16-42)31-8-13-41(14-9-31)38(46)40-22-28-19-29(23-40)21-30(20-28)24-40/h3-7,12,17-18,27-33,45H,8-11,13-16,19-26H2,1-2H3