N-[[1,1-bis(oxidanylidene)-2,5-dihydrothiophen-3-yl]methyl]-N-phenyl-adamantane-1-carboxamide

Systemtic Name: N-[[1,1-bis(oxidanylidene)-2,5-dihydrothiophen-3-yl]methyl]-N-phenyl-adamantane-1-carboxamide Openeye Name: N-[(1,1-dioxo-2,5-dihydrothiophen-3-yl)methyl]-N-phenyl-adamantane-1-carboxamide CAS Name: N-[(1,1-dioxo-2,5-dihydrothiophen-3-yl)methyl]-N-phenyl-1-adamantanecarboxamide IUPAC Name: N-[(1,1-dioxo-2,5-dihydrothiophen-3-yl)methyl]-N-phenyladamantane-1-carboxamide Traditional Name: N-[(1,1-diketo-2,5-dihydrothiophen-3-yl)methyl]-N-phenyl-adamantane-1-carboxamide Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CS1(=O)=O)CN(C2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1C=C(CS1(=O)=O)CN(C2=CC=CC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27NO3S/c24-21(22-11-17-8-18(12-22)10-19(9-17)13-22)23(20-4-2-1-3-5-20)14-16-6-7-27(25,26)15-16/h1-6,17-19H,7-15H2