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

Systemtic Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-iodanyl-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-iodo-benzamide CAS Name: N-[(3,4-dimethoxyanilino)-sulfanylidenemethyl]-4-iodobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-iodobenzamide Traditional Name: N-[(3,4-dimethoxyphenyl)thiocarbamoyl]-4-iodo-benzamide Formula: C16H15IN2O3S MolecularWeight: 442.27137

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15IN2O3S/c1-21-13-8-7-12(9-14(13)22-2)18-16(23)19-15(20)10-3-5-11(17)6-4-10/h3-9H,1-2H3,(H2,18,19,20,23)