ethyl 4-[2-[4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]carbonyloxybutanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)phenyl]carbonyloxybutanoylamino]benzoate Openeye Name: ethyl 4-[2-[4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)benzoyl]oxybutanoylamino]benzoate CAS Name: 4-[[2-[[4-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]phenyl]-oxomethoxy]-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)benzoyl]oxybutanoylamino]benzoate Traditional Name: 4-[2-[4-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]benzoyl]oxybutanoylamino]benzoic acid ethyl ester Formula: C24H26N4O5S MolecularWeight: 482.55204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)OC(=O)C2=CC=C(C=C2)N3C(=NN=C3SC)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)OC(=O)C2=CC=C(C=C2)N3C(=NN=C3SC)C

InChI

InChI=1S/C24H26N4O5S/c1-5-20(21(29)25-18-11-7-16(8-12-18)22(30)32-6-2)33-23(31)17-9-13-19(14-10-17)28-15(3)26-27-24(28)34-4/h7-14,20H,5-6H2,1-4H3,(H,25,29)