N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-N-(2-methoxy-5-piperidinosulfonyl-phenyl)-3-methyl-phthalazine-1-carboxamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)OC

InChI

InChI=1S/C22H24N4O5S/c1-25-22(28)17-9-5-4-8-16(17)20(24-25)21(27)23-18-14-15(10-11-19(18)31-2)32(29,30)26-12-6-3-7-13-26/h4-5,8-11,14H,3,6-7,12-13H2,1-2H3,(H,23,27)