(4-benzamidophenyl) 2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: (4-benzamidophenyl) 2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: (4-benzamidophenyl) 2-[[4-ethyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid (4-benzamidophenyl) ester IUPAC Name: (4-benzamidophenyl) 2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-ethyl-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]acetic acid (4-benzamidophenyl) ester Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C

InChI

InChI=1S/C26H24N4O3S/c1-3-30-24(20-11-7-8-18(2)16-20)28-29-26(30)34-17-23(31)33-22-14-12-21(13-15-22)27-25(32)19-9-5-4-6-10-19/h4-16H,3,17H2,1-2H3,(H,27,32)