N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)adamantane-1-carboxamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)adamantane-1-carboxamide Openeye Name: N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)adamantane-1-carboxamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-1-adamantanecarboxamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)adamantane-1-carboxamide Traditional Name: N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)adamantane-1-carboxamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H35N3O4S/c29-24(25-15-18-11-19(16-25)13-20(12-18)17-25)26-22-14-21(3-4-23(22)27-5-1-2-6-27)33(30,31)28-7-9-32-10-8-28/h3-4,14,18-20H,1-2,5-13,15-17H2,(H,26,29)