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

Systemtic Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-hexanoyl-benzohydrazide Openeye Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-hexanoyl-benzohydrazide CAS Name: 4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N'-(1-oxohexyl)benzohydrazide IUPAC Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-hexanoylbenzohydrazide Traditional Name: N'-caproyl-4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzohydrazide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCCCCC(=O)NNC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C20H26N4O2S/c1-4-5-6-7-18(25)23-24-19(26)17-10-8-16(9-11-17)13-27-20-21-14(2)12-15(3)22-20/h8-12H,4-7,13H2,1-3H3,(H,23,25)(H,24,26)