N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonyl-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carbohydrazide

Systemtic Name: N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonyl-4-ethanoyl-3,5-dimethyl-1H-pyrrole-2-carbohydrazide Openeye Name: 4-acetyl-N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]-3,5-dimethyl-1H-pyrrole-2-carbohydrazide CAS Name: 4-acetyl-N'-[[4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]phenyl]-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carbohydrazide IUPAC Name: 4-acetyl-N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]-3,5-dimethyl-1H-pyrrole-2-carbohydrazide Traditional Name: 4-acetyl-N'-[4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzoyl]-3,5-dimethyl-1H-pyrrole-2-carbohydrazide Formula: C23H25N5O3S MolecularWeight: 451.5413

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=C(C(=C(N3)C)C(=O)C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=C(C(=C(N3)C)C(=O)C)C)C

InChI

InChI=1S/C23H25N5O3S/c1-12-10-13(2)25-23(24-12)32-11-17-6-8-18(9-7-17)21(30)27-28-22(31)20-14(3)19(16(5)29)15(4)26-20/h6-10,26H,11H2,1-5H3,(H,27,30)(H,28,31)