methyl 4-[2-[[5-[1-[(2-methoxyphenyl)carbonylamino]-2-oxidanyl-ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[[5-[1-[(2-methoxyphenyl)carbonylamino]-2-oxidanyl-ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[[5-[2-hydroxy-1-[(2-methoxybenzoyl)amino]ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[[5-[2-hydroxy-1-[[(2-methoxyphenyl)-oxomethyl]amino]ethyl]-4-methyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[[5-[2-hydroxy-1-[(2-methoxybenzoyl)amino]ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[[5-[2-hydroxy-1-(o-anisoylamino)ethyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetyl]amino]benzoic acid methyl ester Formula: C23H25N5O6S MolecularWeight: 499.5395

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)C(CO)NC(=O)C3=CC=CC=C3OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OC)C(CO)NC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C23H25N5O6S/c1-28-20(17(12-29)25-21(31)16-6-4-5-7-18(16)33-2)26-27-23(28)35-13-19(30)24-15-10-8-14(9-11-15)22(32)34-3/h4-11,17,29H,12-13H2,1-3H3,(H,24,30)(H,25,31)