1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-(5-oxidanyl-2-adamantyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-(5-oxidanyl-2-adamantyl)pyrrolidine-2-carboxamide Openeye Name: N-(5-hydroxy-2-adamantyl)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)pyrrolidine-2-carboxamide CAS Name: N-(5-hydroxy-2-adamantyl)-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-2-pyrrolidinecarboxamide IUPAC Name: N-(5-hydroxy-2-adamantyl)-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-(5-hydroxy-2-adamantyl)-1-(7-mesyl-4-methyl-quinazolin-2-yl)pyrrolidine-2-carboxamide Formula: C25H32N4O4S MolecularWeight: 484.61098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCCC3C(=O)NC4C5CC6CC4CC(C6)(C5)O

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCCC3C(=O)NC4C5CC6CC4CC(C6)(C5)O

InChI

InChI=1S/C25H32N4O4S/c1-14-19-6-5-18(34(2,32)33)10-20(19)27-24(26-14)29-7-3-4-21(29)23(30)28-22-16-8-15-9-17(22)13-25(31,11-15)12-16/h5-6,10,15-17,21-22,31H,3-4,7-9,11-13H2,1-2H3,(H,28,30)