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

Systemtic Name: methyl 2-[[3-methylbutyl(2-phenylsulfanylethanoyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[isopentyl-(2-phenylsulfanylacetyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[3-methylbutyl-[1-oxo-2-(phenylthio)ethyl]amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-methylbutyl-(2-phenylsulfanylacetyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[isoamyl-[2-(phenylthio)acetyl]amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3S2/c1-14(2)9-10-21(11-17-20-16(12-26-17)19(23)24-3)18(22)13-25-15-7-5-4-6-8-15/h4-8,12,14H,9-11,13H2,1-3H3