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

Systemtic Name: N-[(4-benzamidophenyl)carbamothioyl]-3-iodanyl-4-methoxy-benzamide Openeye Name: N-[(4-benzamidophenyl)carbamothioyl]-3-iodo-4-methoxy-benzamide CAS Name: N-[(4-benzamidoanilino)-sulfanylidenemethyl]-3-iodo-4-methoxybenzamide IUPAC Name: N-[(4-benzamidophenyl)carbamothioyl]-3-iodo-4-methoxybenzamide Traditional Name: N-[(4-benzamidophenyl)thiocarbamoyl]-3-iodo-4-methoxy-benzamide Formula: C22H18IN3O3S MolecularWeight: 531.36609

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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)NC(=O)C3=CC=CC=C3)I

Isomeric SMILES

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

InChI

InChI=1S/C22H18IN3O3S/c1-29-19-12-7-15(13-18(19)23)21(28)26-22(30)25-17-10-8-16(9-11-17)24-20(27)14-5-3-2-4-6-14/h2-13H,1H3,(H,24,27)(H2,25,26,28,30)