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

Systemtic Name: [(2R)-1-[(2-bromanyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 4-ethyl-1,2,3-thiadiazole-5-carboxylate Openeye Name: [(1R)-2-(2-bromo-4-methyl-anilino)-1-methyl-2-oxo-ethyl] 4-ethylthiadiazole-5-carboxylate CAS Name: 4-ethyl-5-thiadiazolecarboxylic acid [(2R)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-bromo-4-methylanilino)-1-oxopropan-2-yl] 4-ethylthiadiazole-5-carboxylate Traditional Name: 4-ethylthiadiazole-5-carboxylic acid [(1R)-2-(2-bromo-4-methyl-anilino)-2-keto-1-methyl-ethyl] ester Formula: C15H16BrN3O3S MolecularWeight: 398.27484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)OC(C)C(=O)NC2=C(C=C(C=C2)C)Br

Isomeric SMILES

CCC1=C(SN=N1)C(=O)O[C@H](C)C(=O)NC2=C(C=C(C=C2)C)Br

InChI

InChI=1S/C15H16BrN3O3S/c1-4-11-13(23-19-18-11)15(21)22-9(3)14(20)17-12-6-5-8(2)7-10(12)16/h5-7,9H,4H2,1-3H3,(H,17,20)/t9-/m1/s1