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

Systemtic Name: methyl 2-[[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[isopentyl-(4-methoxyphenyl)sulfonyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-methoxyphenyl)sulfonyl-(3-methylbutyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[isoamyl-(4-methoxyphenyl)sulfonyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C18H24N2O5S2 MolecularWeight: 412.52356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O5S2/c1-13(2)9-10-20(11-17-19-16(12-26-17)18(21)25-4)27(22,23)15-7-5-14(24-3)6-8-15/h5-8,12-13H,9-11H2,1-4H3