methyl N-[2-(2,5-dimethylphenoxy)ethanoylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[2-(2,5-dimethylphenoxy)ethanoylcarbamothioylamino]carbamate Openeye Name: methyl N-[[2-(2,5-dimethylphenoxy)acetyl]carbamothioylamino]carbamate CAS Name: N-[[[[2-(2,5-dimethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(2,5-dimethylphenoxy)acetyl]carbamothioylamino]carbamate Traditional Name: N-[[2-(2,5-dimethylphenoxy)acetyl]thiocarbamoylamino]carbamic acid methyl ester Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NNC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NC(=S)NNC(=O)OC

InChI

InChI=1S/C13H17N3O4S/c1-8-4-5-9(2)10(6-8)20-7-11(17)14-12(21)15-16-13(18)19-3/h4-6H,7H2,1-3H3,(H,16,18)(H2,14,15,17,21)