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

Systemtic Name: 3-chloranyl-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)adamantane-1-carboxamide Openeye Name: 3-chloro-N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)adamantane-1-carboxamide CAS Name: 3-chloro-N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)adamantane-1-carboxamide Traditional Name: 3-chloro-N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)adamantane-1-carboxamide Formula: C21H26Cl2N2O3S MolecularWeight: 457.41374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl)Cl

InChI

InChI=1S/C21H26Cl2N2O3S/c22-17-4-3-16(8-18(17)29(27,28)25-5-1-2-6-25)24-19(26)20-9-14-7-15(10-20)12-21(23,11-14)13-20/h3-4,8,14-15H,1-2,5-7,9-13H2,(H,24,26)