4-[[2-(4-chloranyl-2-pyrrolidin-1-ylsulfonyl-phenoxy)-2-methyl-propanoyl]amino]adamantane-1-carboxamide

Systemtic Name: 4-[[2-(4-chloranyl-2-pyrrolidin-1-ylsulfonyl-phenoxy)-2-methyl-propanoyl]amino]adamantane-1-carboxamide Openeye Name: 4-[[2-(4-chloro-2-pyrrolidin-1-ylsulfonyl-phenoxy)-2-methyl-propanoyl]amino]adamantane-1-carboxamide CAS Name: 4-[[2-[4-chloro-2-(1-pyrrolidinylsulfonyl)phenoxy]-2-methyl-1-oxopropyl]amino]-1-adamantanecarboxamide IUPAC Name: 4-[[2-(4-chloro-2-pyrrolidin-1-ylsulfonylphenoxy)-2-methylpropanoyl]amino]adamantane-1-carboxamide Traditional Name: 4-[[2-(4-chloro-2-pyrrolidinosulfonyl-phenoxy)-2-methyl-propanoyl]amino]adamantane-1-carboxamide Formula: C25H34ClN3O5S MolecularWeight: 524.07256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)C(=O)N)OC4=C(C=C(C=C4)Cl)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC(C)(C(=O)NC1C2CC3CC1CC(C3)(C2)C(=O)N)OC4=C(C=C(C=C4)Cl)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H34ClN3O5S/c1-24(2,34-19-6-5-18(26)11-20(19)35(32,33)29-7-3-4-8-29)23(31)28-21-16-9-15-10-17(21)14-25(12-15,13-16)22(27)30/h5-6,11,15-17,21H,3-4,7-10,12-14H2,1-2H3,(H2,27,30)(H,28,31)