2-[[5-(3-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[[5-(3-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[[5-(3-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide CAS Name: 2-[[5-(3-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[[5-(3-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,4-dimethoxyphenyl)acetamide Traditional Name: 2-[[5-(3-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-(2,4-dimethoxyphenyl)acetamide Formula: C25H23ClN4O3S MolecularWeight: 494.99312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)OC)OC)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)OC)OC)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H23ClN4O3S/c1-16-7-9-19(10-8-16)30-24(17-5-4-6-18(26)13-17)28-29-25(30)34-15-23(31)27-21-12-11-20(32-2)14-22(21)33-3/h4-14H,15H2,1-3H3,(H,27,31)