[(2R)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 4-ethyl-1,2,3-thiadiazole-5-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 4-ethyl-1,2,3-thiadiazole-5-carboxylate Openeye Name: [(1R)-2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl] 4-ethylthiadiazole-5-carboxylate CAS Name: 4-ethyl-5-thiadiazolecarboxylic acid [(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] 4-ethylthiadiazole-5-carboxylate Traditional Name: 4-ethylthiadiazole-5-carboxylic acid [(1R)-2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCC1=C(SN=N1)C(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4S/c1-3-18-19(29-24-23-18)21(26)28-14(2)20(25)22-16-9-11-17(12-10-16)27-13-15-7-5-4-6-8-15/h4-12,14H,3,13H2,1-2H3,(H,22,25)/t14-/m1/s1