N'-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: N'-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]-1,3-benzodioxole-5-carbohydrazide Openeye Name: N'-[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]-1,3-benzodioxole-5-carbohydrazide CAS Name: N'-[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: N'-[2-(4-methylquinolin-2-yl)sulfanylacetyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: N'-[2-[(4-methyl-2-quinolyl)thio]acetyl]-1,3-benzodioxole-5-carbohydrazide Formula: C20H17N3O4S MolecularWeight: 395.43168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H17N3O4S/c1-12-8-19(21-15-5-3-2-4-14(12)15)28-10-18(24)22-23-20(25)13-6-7-16-17(9-13)27-11-26-16/h2-9H,10-11H2,1H3,(H,22,24)(H,23,25)