1-[1-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazinyl]-1-oxidanylidene-propan-2-yl]urea

Systemtic Name: 1-[1-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazinyl]-1-oxidanylidene-propan-2-yl]urea Openeye Name: [2-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazino]-1-methyl-2-oxo-ethyl]urea CAS Name: [1-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]hydrazo]-1-oxopropan-2-yl]urea IUPAC Name: [1-[2-(1,3-benzodioxol-5-ylmethylcarbamothioyl)hydrazinyl]-1-oxopropan-2-yl]urea Traditional Name: [2-keto-1-methyl-2-[N'-(piperonylthiocarbamoyl)hydrazino]ethyl]urea Formula: C13H17N5O4S MolecularWeight: 339.37018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N5O4S/c1-7(16-12(14)20)11(19)17-18-13(23)15-5-8-2-3-9-10(4-8)22-6-21-9/h2-4,7H,5-6H2,1H3,(H,17,19)(H3,14,16,20)(H2,15,18,23)