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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]-5-bromanyl-2-methoxy-3-methyl-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-5-bromo-2-methoxy-3-methyl-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-5-bromo-2-methoxy-3-methylbenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-5-bromo-2-methoxy-3-methylbenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-5-bromo-2-methoxy-3-methyl-benzamide Formula: C22H16BrIN2O2S MolecularWeight: 579.24811

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C=C(C=C2)I)C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC2=C(C=C(C=C2)I)C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C22H16BrIN2O2S/c1-12-9-13(23)10-16(20(12)28-2)21(27)25-17-8-7-14(24)11-15(17)22-26-18-5-3-4-6-19(18)29-22/h3-11H,1-2H3,(H,25,27)