propan-2-yl 4-chloranyl-3-[2-[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-chloranyl-3-[2-[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: isopropyl 4-chloro-3-[[2-[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate CAS Name: 4-chloro-3-[[2-[[5-[(2-ethoxy-4-methylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-chloro-3-[[2-[[5-[(2-ethoxy-4-methylphenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-[[5-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]acetyl]amino]benzoic acid isopropyl ester Formula: C26H31ClN4O5S MolecularWeight: 547.06614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC(C)C)Cl)COC3=C(C=C(C=C3)C)OCC

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(=O)OC(C)C)Cl)COC3=C(C=C(C=C3)C)OCC

InChI

InChI=1S/C26H31ClN4O5S/c1-6-31-23(14-35-21-11-8-17(5)12-22(21)34-7-2)29-30-26(31)37-15-24(32)28-20-13-18(9-10-19(20)27)25(33)36-16(3)4/h8-13,16H,6-7,14-15H2,1-5H3,(H,28,32)