N'-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyladamantane-1-carbohydrazide

Systemtic Name: N'-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyladamantane-1-carbohydrazide Openeye Name: N'-(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)adamantane-1-carbohydrazide CAS Name: N'-[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1-adamantanecarbohydrazide IUPAC Name: N'-(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)adamantane-1-carbohydrazide Traditional Name: N'-(2-chloro-5-pyrrolidinosulfonyl-benzoyl)adamantane-1-carbohydrazide Formula: C22H28ClN3O4S MolecularWeight: 465.99342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O4S/c23-19-4-3-17(31(29,30)26-5-1-2-6-26)10-18(19)20(27)24-25-21(28)22-11-14-7-15(12-22)9-16(8-14)13-22/h3-4,10,14-16H,1-2,5-9,11-13H2,(H,24,27)(H,25,28)