5-(4-methoxyphthalazin-1-yl)-2-methyl-N-[(2R)-1-oxidanylbutan-2-yl]benzenesulfonamide

Systemtic Name: 5-(4-methoxyphthalazin-1-yl)-2-methyl-N-[(2R)-1-oxidanylbutan-2-yl]benzenesulfonamide Openeye Name: N-[(1R)-1-(hydroxymethyl)propyl]-5-(4-methoxyphthalazin-1-yl)-2-methyl-benzenesulfonamide CAS Name: N-[(2R)-1-hydroxybutan-2-yl]-5-(4-methoxy-1-phthalazinyl)-2-methylbenzenesulfonamide IUPAC Name: N-[(2R)-1-hydroxybutan-2-yl]-5-(4-methoxyphthalazin-1-yl)-2-methylbenzenesulfonamide Traditional Name: 5-(4-methoxyphthalazin-1-yl)-2-methyl-N-[(1R)-1-methylolpropyl]benzenesulfonamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NS(=O)(=O)C1=C(C=CC(=C1)C2=NN=C(C3=CC=CC=C32)OC)C

Isomeric SMILES

CC[C@H](CO)NS(=O)(=O)C1=C(C=CC(=C1)C2=NN=C(C3=CC=CC=C32)OC)C

InChI

InChI=1S/C20H23N3O4S/c1-4-15(12-24)23-28(25,26)18-11-14(10-9-13(18)2)19-16-7-5-6-8-17(16)20(27-3)22-21-19/h5-11,15,23-24H,4,12H2,1-3H3/t15-/m1/s1