N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]-5-bromanyl-2-methoxy-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]-5-bromanyl-2-methoxy-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-5-bromo-2-methoxy-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-5-bromo-2-methoxybenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-5-bromo-2-methoxybenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-5-bromo-2-methoxy-benzamide Formula: C21H14BrIN2O2S MolecularWeight: 565.22153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC2=C(C=C(C=C2)I)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC2=C(C=C(C=C2)I)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H14BrIN2O2S/c1-27-18-9-6-12(22)10-15(18)20(26)24-16-8-7-13(23)11-14(16)21-25-17-4-2-3-5-19(17)28-21/h2-11H,1H3,(H,24,26)