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

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-iodo-4-methylphenyl)-2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-iodo-4-methylphenyl)-2-[[4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-2-[[4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H17IN4OS MolecularWeight: 464.32325

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CC(=C(C=C3)C)I

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NN=C2SCC(=O)NC3=CC(=C(C=C3)C)I

InChI

InChI=1S/C18H17IN4OS/c1-12-3-7-15(8-4-12)23-11-20-22-18(23)25-10-17(24)21-14-6-5-13(2)16(19)9-14/h3-9,11H,10H2,1-2H3,(H,21,24)