N-[3-oxidanylidene-3-[(4-piperidin-1-ylsulfonylphenyl)amino]propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-[(4-piperidin-1-ylsulfonylphenyl)amino]propyl]adamantane-1-carboxamide Openeye Name: N-[3-oxo-3-[4-(1-piperidylsulfonyl)anilino]propyl]adamantane-1-carboxamide CAS Name: N-[3-oxo-3-[4-(1-piperidinylsulfonyl)anilino]propyl]-1-adamantanecarboxamide IUPAC Name: N-[3-oxo-3-(4-piperidin-1-ylsulfonylanilino)propyl]adamantane-1-carboxamide Traditional Name: N-[3-keto-3-(4-piperidinosulfonylanilino)propyl]adamantane-1-carboxamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H35N3O4S/c29-23(8-9-26-24(30)25-15-18-12-19(16-25)14-20(13-18)17-25)27-21-4-6-22(7-5-21)33(31,32)28-10-2-1-3-11-28/h4-7,18-20H,1-3,8-17H2,(H,26,30)(H,27,29)