N-(4-iodanyl-2-methyl-phenyl)-2-[[2-(phenylcarbonyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-2-[[2-(phenylcarbonyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[2-benzoyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: 2-[[2-benzoyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(4-iodo-2-methylphenyl)acetamide IUPAC Name: 2-[(2-benzoyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[[2-benzoyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C23H18IN5O2S MolecularWeight: 555.39079

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CSC2=NC(=NN2C(=O)C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C23H18IN5O2S/c1-15-12-18(24)9-10-19(15)26-20(30)14-32-23-27-21(17-8-5-11-25-13-17)28-29(23)22(31)16-6-3-2-4-7-16/h2-13H,14H2,1H3,(H,26,30)