[2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: [2-(4-tert-butylphenyl)-2-oxidanylidene-ethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: [2-(4-tert-butylphenyl)-2-oxo-ethyl] 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid [2-(4-tert-butylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-tert-butylphenyl)-2-oxoethyl] 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid [2-(4-tert-butylphenyl)-2-keto-ethyl] ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC(=O)C2=CC=C(C=C2)C(C)(C)C)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC(=O)C2=CC=C(C=C2)C(C)(C)C)NC

InChI

InChI=1S/C18H22N2O3S/c1-11-15(16(19-5)24-20-11)17(22)23-10-14(21)12-6-8-13(9-7-12)18(2,3)4/h6-9,19H,10H2,1-5H3