2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H22N4O6S/c1-14-6-7-15(12-18(14)32(29,30)24-8-10-31-11-9-24)22-19(26)13-25-21(28)17-5-3-2-4-16(17)20(27)23-25/h2-7,12H,8-11,13H2,1H3,(H,22,26)(H,23,27)