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

Systemtic Name: methyl 2-[[3-methoxypropyl(2-phenylsulfanylethanoyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[3-methoxypropyl-(2-phenylsulfanylacetyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[3-methoxypropyl-[1-oxo-2-(phenylthio)ethyl]amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-methoxypropyl-(2-phenylsulfanylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[3-methoxypropyl-[2-(phenylthio)acetyl]amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)CSC2=CC=CC=C2

Isomeric SMILES

COCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O4S2/c1-23-10-6-9-20(11-16-19-15(12-26-16)18(22)24-2)17(21)13-25-14-7-4-3-5-8-14/h3-5,7-8,12H,6,9-11,13H2,1-2H3