[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methylsulfanyl]benzoate CAS Name: 2-[(2-methyl-4-thiazolyl)methylthio]benzoic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoate Traditional Name: 2-[(2-methylthiazol-4-yl)methylthio]benzoic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC=CC=C1SCC2=CSC(=N2)C

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CC=CC=C1SCC2=CSC(=N2)C

InChI

InChI=1S/C19H24N2O3S2/c1-4-7-13(2)20-18(22)10-24-19(23)16-8-5-6-9-17(16)26-12-15-11-25-14(3)21-15/h5-6,8-9,11,13H,4,7,10,12H2,1-3H3,(H,20,22)