N-(4-iodophenyl)-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(4-iodophenyl)-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(4-iodophenyl)-2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(4-iodophenyl)-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(4-iodophenyl)-2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(4-iodophenyl)-2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H19IN4OS MolecularWeight: 478.34983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SC(C)C(=O)NC3=CC=C(C=C3)I

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)SC(C)C(=O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C19H19IN4OS/c1-12-6-4-5-7-16(12)17-22-23-19(24(17)3)26-13(2)18(25)21-15-10-8-14(20)9-11-15/h4-11,13H,1-3H3,(H,21,25)