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

Systemtic Name: (5S,7R)-3-chloranyl-N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]adamantane-1-carboxamide Openeye Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]adamantane-1-carboxamide CAS Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methylphenyl]-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methylphenyl]adamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]adamantane-1-carboxamide Formula: C20H27ClN2O3S MolecularWeight: 410.95798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Cl)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H27ClN2O3S/c1-13-4-5-16(7-17(13)27(25,26)23(2)3)22-18(24)19-8-14-6-15(9-19)11-20(21,10-14)12-19/h4-5,7,14-15H,6,8-12H2,1-3H3,(H,22,24)/t14-,15+,19?,20?