4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-(4-methoxyphenyl)carbonyl-benzohydrazide

Systemtic Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-(4-methoxyphenyl)carbonyl-benzohydrazide Openeye Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-(4-methoxybenzoyl)benzohydrazide CAS Name: 4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N'-[(4-methoxyphenyl)-oxomethyl]benzohydrazide IUPAC Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-(4-methoxybenzoyl)benzohydrazide Traditional Name: 4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-N'-p-anisoyl-benzohydrazide Formula: C22H22N4O3S MolecularWeight: 422.50008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H22N4O3S/c1-14-12-15(2)24-22(23-14)30-13-16-4-6-17(7-5-16)20(27)25-26-21(28)18-8-10-19(29-3)11-9-18/h4-12H,13H2,1-3H3,(H,25,27)(H,26,28)