N'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carbohydrazide

Systemtic Name: N'-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carbohydrazide Openeye Name: N'-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-2-(3,4-dimethylphenyl)sulfanyl-pyridine-3-carbohydrazide CAS Name: N'-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-2-[(3,4-dimethylphenyl)thio]-3-pyridinecarbohydrazide IUPAC Name: N'-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbohydrazide Traditional Name: N'-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-2-[(3,4-dimethylphenyl)thio]nicotinohydrazide Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C23H21N3O4S/c1-14-5-7-17(12-15(14)2)31-23-18(4-3-9-24-23)22(28)26-25-21(27)16-6-8-19-20(13-16)30-11-10-29-19/h3-9,12-13H,10-11H2,1-2H3,(H,25,27)(H,26,28)