ethyl 2-[[2-phenylsulfanylethanoyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[2-phenylsulfanylethanoyl(propan-2-yl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[isopropyl-(2-phenylsulfanylacetyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[1-oxo-2-(phenylthio)ethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2-phenylsulfanylacetyl)-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[isopropyl-[2-(phenylthio)acetyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)CSC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O3S2/c1-4-23-18(22)15-11-25-16(19-15)10-20(13(2)3)17(21)12-24-14-8-6-5-7-9-14/h5-9,11,13H,4,10,12H2,1-3H3