3-chloranyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[(2-morpholinosulfonylphenyl)methyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-(2-morpholinosulfonylbenzyl)adamantane-1-carboxamide Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC=C2CNC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C22H29ClN2O4S/c23-22-12-16-9-17(13-22)11-21(10-16,15-22)20(26)24-14-18-3-1-2-4-19(18)30(27,28)25-5-7-29-8-6-25/h1-4,16-17H,5-15H2,(H,24,26)