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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)CSC2=CC=CC=C2

Isomeric SMILES

CCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)CSC2=CC=CC=C2

InChI

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