N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[(3-iodanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[(3-iodo-4-methoxy-benzoyl)amino]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[[(3-iodo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[(3-iodo-4-methoxybenzoyl)amino]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[(3-iodo-4-methoxy-benzoyl)amino]thiocarbamoyl]cyclohexanecarboxamide Formula: C16H20IN3O3S MolecularWeight: 461.31777

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2CCCCC2)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2CCCCC2)I

InChI

InChI=1S/C16H20IN3O3S/c1-23-13-8-7-11(9-12(13)17)15(22)19-20-16(24)18-14(21)10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,19,22)(H2,18,20,21,24)