N'-(3-cyclopentylpropanoyl)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide

Systemtic Name: N'-(3-cyclopentylpropanoyl)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide Openeye Name: N'-(3-cyclopentylpropanoyl)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide CAS Name: N'-(3-cyclopentyl-1-oxopropyl)-4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]benzohydrazide IUPAC Name: N'-(3-cyclopentylpropanoyl)-4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzohydrazide Traditional Name: N'-(3-cyclopentylpropanoyl)-4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzohydrazide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)CCC3CCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)CCC3CCCC3)C

InChI

InChI=1S/C22H28N4O2S/c1-15-13-16(2)24-22(23-15)29-14-18-7-10-19(11-8-18)21(28)26-25-20(27)12-9-17-5-3-4-6-17/h7-8,10-11,13,17H,3-6,9,12,14H2,1-2H3,(H,25,27)(H,26,28)