N-[3-[(Z)-N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-C-methyl-carbonimidoyl]phenyl]ethanamide

Systemtic Name: N-[3-[(Z)-N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-C-methyl-carbonimidoyl]phenyl]ethanamide Openeye Name: N-[3-[(Z)-N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-C-methyl-carbonimidoyl]phenyl]acetamide CAS Name: N-[3-[(1Z)-1-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenyl]acetamide IUPAC Name: N-[3-[(Z)-N-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)-C-methylcarbonimidoyl]phenyl]acetamide Traditional Name: N-[3-[(Z)-C-methyl-N-(piperonylthiocarbamoylamino)carbonimidoyl]phenyl]acetamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC1=CC2=C(C=C1)OCO2)C3=CC(=CC=C3)NC(=O)C

Isomeric SMILES

C/C(=N/NC(=S)NCC1=CC2=C(C=C1)OCO2)/C3=CC(=CC=C3)NC(=O)C

InChI

InChI=1S/C19H20N4O3S/c1-12(15-4-3-5-16(9-15)21-13(2)24)22-23-19(27)20-10-14-6-7-17-18(8-14)26-11-25-17/h3-9H,10-11H2,1-2H3,(H,21,24)(H2,20,23,27)/b22-12-