1-(1-adamantylcarbonyl)-N-(3-piperidin-1-ylsulfonylphenyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(1-adamantylcarbonyl)-N-(3-piperidin-1-ylsulfonylphenyl)pyrrolidine-2-carboxamide Openeye Name: 1-(adamantane-1-carbonyl)-N-[3-(1-piperidylsulfonyl)phenyl]pyrrolidine-2-carboxamide CAS Name: 1-[1-adamantyl(oxo)methyl]-N-[3-(1-piperidinylsulfonyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(adamantane-1-carbonyl)-N-(3-piperidin-1-ylsulfonylphenyl)pyrrolidine-2-carboxamide Traditional Name: 1-(adamantane-1-carbonyl)-N-(3-piperidinosulfonylphenyl)pyrrolidine-2-carboxamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H37N3O4S/c31-25(28-22-6-4-7-23(15-22)35(33,34)29-9-2-1-3-10-29)24-8-5-11-30(24)26(32)27-16-19-12-20(17-27)14-21(13-19)18-27/h4,6-7,15,19-21,24H,1-3,5,8-14,16-18H2,(H,28,31)