2-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]phthalazin-1-one

Systemtic Name: 2-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]phthalazin-1-one Openeye Name: 2-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]phthalazin-1-one CAS Name: 2-[[4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]-1-piperazinyl]methyl]-1-phthalazinone IUPAC Name: 2-[[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]methyl]phthalazin-1-one Traditional Name: 2-[[4-(2,6-dimethylmorpholino)sulfonylpiperazino]methyl]phthalazin-1-one Formula: C19H27N5O4S MolecularWeight: 421.51378

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C19H27N5O4S/c1-15-12-23(13-16(2)28-15)29(26,27)22-9-7-21(8-10-22)14-24-19(25)18-6-4-3-5-17(18)11-20-24/h3-6,11,15-16H,7-10,12-14H2,1-2H3