N-[1-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-1-oxidanylidene-propan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-methyl-2-[(4-morpholinosulfonylphenyl)methylamino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[1-[[4-(4-morpholinylsulfonyl)phenyl]methylamino]-1-oxopropan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-1-oxopropan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-keto-1-methyl-2-[(4-morpholinosulfonylbenzyl)amino]ethyl]adamantane-1-carboxamide Formula: C25H35N3O5S MolecularWeight: 489.6275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H35N3O5S/c1-17(27-24(30)25-13-19-10-20(14-25)12-21(11-19)15-25)23(29)26-16-18-2-4-22(5-3-18)34(31,32)28-6-8-33-9-7-28/h2-5,17,19-21H,6-16H2,1H3,(H,26,29)(H,27,30)