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

Systemtic Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-[3-(furan-2-yl)propanoyl]benzohydrazide Openeye Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-[3-(2-furyl)propanoyl]benzohydrazide CAS Name: 4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N'-[3-(2-furanyl)-1-oxopropyl]benzohydrazide IUPAC Name: 4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-[3-(furan-2-yl)propanoyl]benzohydrazide Traditional Name: 4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-N'-[3-(2-furyl)propanoyl]benzohydrazide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)CCC3=CC=CO3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)CCC3=CC=CO3)C

InChI

InChI=1S/C21H22N4O3S/c1-14-12-15(2)23-21(22-14)29-13-16-5-7-17(8-6-16)20(27)25-24-19(26)10-9-18-4-3-11-28-18/h3-8,11-12H,9-10,13H2,1-2H3,(H,24,26)(H,25,27)