N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-iodanyl-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-iodanyl-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-iodo-benzamide CAS Name: N-[(3,4-dimethoxyanilino)-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-2-iodobenzamide Traditional Name: N-[(3,4-dimethoxyphenyl)thiocarbamoyl]-2-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=CC=C2I)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2I)OC

InChI

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