(5S,7R)-3-chloranyl-N-(4-methylsulfonylphenyl)adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-chloranyl-N-(4-methylsulfonylphenyl)adamantane-1-carboxamide Openeye Name: (5S,7R)-3-chloro-N-(4-methylsulfonylphenyl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-chloro-N-(4-methylsulfonylphenyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-chloro-N-(4-methylsulfonylphenyl)adamantane-1-carboxamide Traditional Name: (5S,7R)-3-chloro-N-(4-mesylphenyl)adamantane-1-carboxamide Formula: C18H22ClNO3S MolecularWeight: 367.89018

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClNO3S/c1-24(22,23)15-4-2-14(3-5-15)20-16(21)17-7-12-6-13(8-17)10-18(19,9-12)11-17/h2-5,12-13H,6-11H2,1H3,(H,20,21)/t12-,13+,17?,18?