3-iodanyl-4-methoxy-N-[(4-phenylmethoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methoxy-N-[(4-phenylmethoxyphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-benzyloxyphenyl)carbamothioyl]-3-iodo-4-methoxy-benzamide CAS Name: 3-iodo-4-methoxy-N-[(4-phenylmethoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methoxy-N-[(4-phenylmethoxyphenyl)carbamothioyl]benzamide Traditional Name: N-[(4-benzoxyphenyl)thiocarbamoyl]-3-iodo-4-methoxy-benzamide Formula: C22H19IN2O3S MolecularWeight: 518.36733

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC3=CC=CC=C3)I

InChI

InChI=1S/C22H19IN2O3S/c1-27-20-12-7-16(13-19(20)23)21(26)25-22(29)24-17-8-10-18(11-9-17)28-14-15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H2,24,25,26,29)