N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]-4-phenylmethoxy-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]-4-phenylmethoxy-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-4-benzyloxy-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-4-phenylmethoxybenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-4-phenylmethoxybenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-4-benzoxy-benzamide Formula: C27H19IN2O2S MolecularWeight: 562.42143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)I)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)I)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H19IN2O2S/c28-20-12-15-23(22(16-20)27-30-24-8-4-5-9-25(24)33-27)29-26(31)19-10-13-21(14-11-19)32-17-18-6-2-1-3-7-18/h1-16H,17H2,(H,29,31)