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

Systemtic Name: methyl N-[(3-bromanyl-4-ethoxy-phenyl)carbonylcarbamothioylamino]carbamate Openeye Name: methyl N-[(3-bromo-4-ethoxy-benzoyl)carbamothioylamino]carbamate CAS Name: N-[[[[(3-bromo-4-ethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[(3-bromo-4-ethoxybenzoyl)carbamothioylamino]carbamate Traditional Name: N-[(3-bromo-4-ethoxy-benzoyl)thiocarbamoylamino]carbamic acid methyl ester Formula: C12H14BrN3O4S MolecularWeight: 376.22626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)OC)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)OC)Br

InChI

InChI=1S/C12H14BrN3O4S/c1-3-20-9-5-4-7(6-8(9)13)10(17)14-11(21)15-16-12(18)19-2/h4-6H,3H2,1-2H3,(H,16,18)(H2,14,15,17,21)