N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-3-iodanyl-4-methoxy-benzamide

Systemtic Name: N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-3-iodanyl-4-methoxy-benzamide Openeye Name: N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-3-iodo-4-methoxy-benzamide CAS Name: N-[[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-iodo-4-methoxybenzamide IUPAC Name: N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-3-iodo-4-methoxybenzamide Traditional Name: 3-iodo-4-methoxy-N-[(veratroylamino)thiocarbamoyl]benzamide Formula: C18H18IN3O5S MolecularWeight: 515.32209

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OC)I)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OC)I)OC

InChI

InChI=1S/C18H18IN3O5S/c1-25-13-6-4-10(8-12(13)19)16(23)20-18(28)22-21-17(24)11-5-7-14(26-2)15(9-11)27-3/h4-9H,1-3H3,(H,21,24)(H2,20,22,23,28)