methyl N-[[3-bromanyl-4-(2-methoxyethoxy)phenyl]carbonylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[[3-bromanyl-4-(2-methoxyethoxy)phenyl]carbonylcarbamothioylamino]carbamate Openeye Name: methyl N-[[3-bromo-4-(2-methoxyethoxy)benzoyl]carbamothioylamino]carbamate CAS Name: N-[[[[[3-bromo-4-(2-methoxyethoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[3-bromo-4-(2-methoxyethoxy)benzoyl]carbamothioylamino]carbamate Traditional Name: N-[[3-bromo-4-(2-methoxyethoxy)benzoyl]thiocarbamoylamino]carbamic acid methyl ester Formula: C13H16BrN3O5S MolecularWeight: 406.25224

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)OC)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)OC)Br

InChI

InChI=1S/C13H16BrN3O5S/c1-20-5-6-22-10-4-3-8(7-9(10)14)11(18)15-12(23)16-17-13(19)21-2/h3-4,7H,5-6H2,1-2H3,(H,17,19)(H2,15,16,18,23)