1-(1-adamantylcarbonyl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]pyrrolidine-2-carboxamide Formula: C24H35N3O2S MolecularWeight: 429.6186

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCCN1C(=O)C23CC4CC(C2)CC(C4)C3)C5=CSC=C5

Isomeric SMILES

CN(C)C(CNC(=O)C1CCCN1C(=O)C23CC4CC(C2)CC(C4)C3)C5=CSC=C5

InChI

InChI=1S/C24H35N3O2S/c1-26(2)21(19-5-7-30-15-19)14-25-22(28)20-4-3-6-27(20)23(29)24-11-16-8-17(12-24)10-18(9-16)13-24/h5,7,15-18,20-21H,3-4,6,8-14H2,1-2H3,(H,25,28)