2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(1,3-diketobenzo[de]isoquinolin-2-yl)-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)S(=O)(=O)N5CCCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C26H25N3O5S/c1-17-11-12-19(15-22(17)35(33,34)28-13-3-2-4-14-28)27-23(30)16-29-25(31)20-9-5-7-18-8-6-10-21(24(18)20)26(29)32/h5-12,15H,2-4,13-14,16H2,1H3,(H,27,30)