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

Systemtic Name: N'-cyclohexylcarbonyl-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide Openeye Name: N'-(cyclohexanecarbonyl)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide CAS Name: N'-[cyclohexyl(oxo)methyl]-4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzohydrazide IUPAC Name: N'-(cyclohexanecarbonyl)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide Traditional Name: N'-(cyclohexanecarbonyl)-4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzohydrazide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3CCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3CCCCC3)C

InChI

InChI=1S/C21H26N4O2S/c1-14-12-15(2)23-21(22-14)28-13-16-8-10-18(11-9-16)20(27)25-24-19(26)17-6-4-3-5-7-17/h8-12,17H,3-7,13H2,1-2H3,(H,24,26)(H,25,27)