3-methyl-N-(3-morpholin-4-ylsulfonylphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-(3-morpholin-4-ylsulfonylphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-(3-morpholinosulfonylphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[3-(4-morpholinylsulfonyl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-(3-morpholin-4-ylsulfonylphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-(3-morpholinosulfonylphenyl)phthalazine-1-carboxamide Formula: C20H20N4O5S MolecularWeight: 428.4616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H20N4O5S/c1-23-20(26)17-8-3-2-7-16(17)18(22-23)19(25)21-14-5-4-6-15(13-14)30(27,28)24-9-11-29-12-10-24/h2-8,13H,9-12H2,1H3,(H,21,25)