5-(4-chloranylphthalazin-1-yl)-2-methyl-N-[(2S)-1-oxidanylbutan-2-yl]benzenesulfonamide

Systemtic Name: 5-(4-chloranylphthalazin-1-yl)-2-methyl-N-[(2S)-1-oxidanylbutan-2-yl]benzenesulfonamide Openeye Name: 5-(4-chlorophthalazin-1-yl)-N-[(1S)-1-(hydroxymethyl)propyl]-2-methyl-benzenesulfonamide CAS Name: 5-(4-chloro-1-phthalazinyl)-N-[(2S)-1-hydroxybutan-2-yl]-2-methylbenzenesulfonamide IUPAC Name: 5-(4-chlorophthalazin-1-yl)-N-[(2S)-1-hydroxybutan-2-yl]-2-methylbenzenesulfonamide Traditional Name: 5-(4-chlorophthalazin-1-yl)-2-methyl-N-[(1S)-1-methylolpropyl]benzenesulfonamide Formula: C19H20ClN3O3S MolecularWeight: 405.8984

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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)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3O3S/c1-3-14(11-24)23-27(25,26)17-10-13(9-8-12(17)2)18-15-6-4-5-7-16(15)19(20)22-21-18/h4-10,14,23-24H,3,11H2,1-2H3/t14-/m0/s1