2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-(6-oxidanylidene-1H-pyridazin-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-2-methyl-5-(6-oxo-1H-pyridazin-3-yl)benzenesulfonamide CAS Name: 2-methyl-5-(6-oxo-1H-pyridazin-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide IUPAC Name: 2-methyl-5-(6-oxo-1H-pyridazin-3-yl)-N-[(4-propan-2-yloxyphenyl)methyl]benzenesulfonamide Traditional Name: N-(4-isopropoxybenzyl)-5-(6-keto-1H-pyridazin-3-yl)-2-methyl-benzenesulfonamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C=C2)S(=O)(=O)NCC3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C=C2)S(=O)(=O)NCC3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C21H23N3O4S/c1-14(2)28-18-8-5-16(6-9-18)13-22-29(26,27)20-12-17(7-4-15(20)3)19-10-11-21(25)24-23-19/h4-12,14,22H,13H2,1-3H3,(H,24,25)