3-bromanyl-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C19H19BrIN3O5S MolecularWeight: 608.24473

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)I)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)I)Br

InChI

InChI=1S/C19H19BrIN3O5S/c1-27-7-8-29-15-5-3-11(9-13(15)20)17(25)22-19(30)24-23-18(26)12-4-6-16(28-2)14(21)10-12/h3-6,9-10H,7-8H2,1-2H3,(H,23,26)(H2,22,24,25,30)