N-[2-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinyl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinyl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]hydrazo]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)hydrazinyl]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-[N'-(2-nitro-4-pyrrolidinosulfonyl-phenyl)hydrazino]ethyl]adamantane-1-carboxamide Formula: C23H31N5O6S MolecularWeight: 505.58714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NNC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NNC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

InChI

InChI=1S/C23H31N5O6S/c29-21(14-24-22(30)23-11-15-7-16(12-23)9-17(8-15)13-23)26-25-19-4-3-18(10-20(19)28(31)32)35(33,34)27-5-1-2-6-27/h3-4,10,15-17,25H,1-2,5-9,11-14H2,(H,24,30)(H,26,29)