2-methyl-N-(3-methylsulfanylphenyl)-5-(4-oxidanylidene-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide

Systemtic Name: 2-methyl-N-(3-methylsulfanylphenyl)-5-(4-oxidanylidene-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide Openeye Name: 2-methyl-N-(3-methylsulfanylphenyl)-5-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide CAS Name: 2-methyl-N-[3-(methylthio)phenyl]-5-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide IUPAC Name: 2-methyl-N-(3-methylsulfanylphenyl)-5-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)benzenesulfonamide Traditional Name: 5-(4-keto-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)-2-methyl-N-[3-(methylthio)phenyl]benzenesulfonamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NNC(=O)C3=C2CCCC3)S(=O)(=O)NC4=CC(=CC=C4)SC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NNC(=O)C3=C2CCCC3)S(=O)(=O)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C22H23N3O3S2/c1-14-10-11-15(21-18-8-3-4-9-19(18)22(26)24-23-21)12-20(14)30(27,28)25-16-6-5-7-17(13-16)29-2/h5-7,10-13,25H,3-4,8-9H2,1-2H3,(H,24,26)