3-chloranyl-N-(3-morpholin-4-ylsulfonylphenyl)adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-(3-morpholin-4-ylsulfonylphenyl)adamantane-1-carboxamide Openeye Name: 3-chloro-N-(3-morpholinosulfonylphenyl)adamantane-1-carboxamide CAS Name: 3-chloro-N-[3-(4-morpholinylsulfonyl)phenyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-(3-morpholin-4-ylsulfonylphenyl)adamantane-1-carboxamide Traditional Name: 3-chloro-N-(3-morpholinosulfonylphenyl)adamantane-1-carboxamide Formula: C21H27ClN2O4S MolecularWeight: 438.96808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O4S/c22-21-12-15-8-16(13-21)11-20(10-15,14-21)19(25)23-17-2-1-3-18(9-17)29(26,27)24-4-6-28-7-5-24/h1-3,9,15-16H,4-8,10-14H2,(H,23,25)