N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-2-iodanyl-benzamide

Systemtic Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-2-iodanyl-benzamide Openeye Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-2-iodo-benzamide CAS Name: N-[4-[4-(2-acetamidoethyl)phenyl]-2-thiazolyl]-2-iodobenzamide IUPAC Name: N-[4-[4-(2-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-2-iodobenzamide Traditional Name: N-[4-[4-(2-acetamidoethyl)phenyl]thiazol-2-yl]-2-iodo-benzamide Formula: C20H18IN3O2S MolecularWeight: 491.34529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

CC(=O)NCCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C20H18IN3O2S/c1-13(25)22-11-10-14-6-8-15(9-7-14)18-12-27-20(23-18)24-19(26)16-4-2-3-5-17(16)21/h2-9,12H,10-11H2,1H3,(H,22,25)(H,23,24,26)