N'-[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]-4-methylsulfonyl-benzohydrazide

Systemtic Name: N'-[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]-4-methylsulfonyl-benzohydrazide Openeye Name: N'-[4-(3,4-dimethylphenyl)-4-oxo-butanoyl]-4-methylsulfonyl-benzohydrazide CAS Name: N'-[4-(3,4-dimethylphenyl)-1,4-dioxobutyl]-4-methylsulfonylbenzohydrazide IUPAC Name: N'-[4-(3,4-dimethylphenyl)-4-oxobutanoyl]-4-methylsulfonylbenzohydrazide Traditional Name: N'-[4-(3,4-dimethylphenyl)-4-keto-butanoyl]-4-mesyl-benzohydrazide Formula: C20H22N2O5S MolecularWeight: 402.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)NNC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C

InChI

InChI=1S/C20H22N2O5S/c1-13-4-5-16(12-14(13)2)18(23)10-11-19(24)21-22-20(25)15-6-8-17(9-7-15)28(3,26)27/h4-9,12H,10-11H2,1-3H3,(H,21,24)(H,22,25)