(5S,7R)-3-chloranyl-N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-chloranyl-N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]adamantane-1-carboxamide Formula: C20H27ClN2O4S MolecularWeight: 426.95738

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Cl)OC

InChI

InChI=1S/C20H27ClN2O4S/c1-23(2)28(25,26)17-7-15(4-5-16(17)27-3)22-18(24)19-8-13-6-14(9-19)11-20(21,10-13)12-19/h4-5,7,13-14H,6,8-12H2,1-3H3,(H,22,24)/t13-,14+,19?,20?