methyl N-[2-(4-ethylphenoxy)ethanoylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[2-(4-ethylphenoxy)ethanoylcarbamothioylamino]carbamate Openeye Name: methyl N-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]carbamate CAS Name: N-[[[[2-(4-ethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]carbamate Traditional Name: N-[[2-(4-ethylphenoxy)acetyl]thiocarbamoylamino]carbamic acid methyl ester Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)OC

InChI

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