N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclohexyl-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclohexyl-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-cyclohexyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-cyclohexyl-N-[(3S)-1,1-dioxo-3-thiolanyl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-cyclohexyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: N-cyclohexyl-N-[(3S)-1,1-diketothiolan-3-yl]-2-(4-ketocinnolin-1-yl)acetamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCS(=O)(=O)C2)C(=O)CN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

C1CCC(CC1)N([C@H]2CCS(=O)(=O)C2)C(=O)CN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C20H25N3O4S/c24-19-12-21-22(18-9-5-4-8-17(18)19)13-20(25)23(15-6-2-1-3-7-15)16-10-11-28(26,27)14-16/h4-5,8-9,12,15-16H,1-3,6-7,10-11,13-14H2/t16-/m0/s1