2-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazinyl]-N-(4-methylphenyl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazinyl]-N-(4-methylphenyl)-2-oxidanylidene-ethanamide Openeye Name: 2-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazino]-2-oxo-N-(p-tolyl)acetamide CAS Name: 2-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]hydrazo]-N-(4-methylphenyl)-2-oxoacetamide IUPAC Name: 2-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazinyl]-N-(4-methylphenyl)-2-oxoacetamide Traditional Name: 2-keto-2-[N'-(piperonylthiocarbamoyl)hydrazino]-N-(p-tolyl)acetamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18N4O4S/c1-11-2-5-13(6-3-11)20-16(23)17(24)21-22-18(27)19-9-12-4-7-14-15(8-12)26-10-25-14/h2-8H,9-10H2,1H3,(H,20,23)(H,21,24)(H2,19,22,27)