N-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)adamantane-1-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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