methyl N-[(3-iodanyl-4-methoxy-phenyl)carbonylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[(3-iodanyl-4-methoxy-phenyl)carbonylcarbamothioylamino]carbamate Openeye Name: methyl N-[(3-iodo-4-methoxy-benzoyl)carbamothioylamino]carbamate CAS Name: N-[[[[(3-iodo-4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[(3-iodo-4-methoxybenzoyl)carbamothioylamino]carbamate Traditional Name: N-[(3-iodo-4-methoxy-benzoyl)thiocarbamoylamino]carbamic acid methyl ester Formula: C11H12IN3O4S MolecularWeight: 409.20015

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)OC)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)OC)I

InChI

InChI=1S/C11H12IN3O4S/c1-18-8-4-3-6(5-7(8)12)9(16)13-10(20)14-15-11(17)19-2/h3-5H,1-2H3,(H,15,17)(H2,13,14,16,20)