[1-oxidanylidene-1-[(4-phenoxyphenyl)amino]butan-2-yl] 4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)benzoate

Systemtic Name: [1-oxidanylidene-1-[(4-phenoxyphenyl)amino]butan-2-yl] 4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)benzoate Openeye Name: 1-[(4-phenoxyphenyl)carbamoyl]propyl 4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)benzoate CAS Name: 4-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]benzoic acid [1-oxo-1-(4-phenoxyanilino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenoxyanilino)butan-2-yl] 4-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)benzoate Traditional Name: 4-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]benzoic acid 1-[(4-phenoxyphenyl)carbamoyl]propyl ester Formula: C27H26N4O4S MolecularWeight: 502.58474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)N4C(=NN=C4SC)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)N4C(=NN=C4SC)C

InChI

InChI=1S/C27H26N4O4S/c1-4-24(25(32)28-20-12-16-23(17-13-20)34-22-8-6-5-7-9-22)35-26(33)19-10-14-21(15-11-19)31-18(2)29-30-27(31)36-3/h5-17,24H,4H2,1-3H3,(H,28,32)