methyl 2-[[(4-acetamidophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-acetamidophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-acetamidophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[(4-acetamidophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-acetamidophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-acetamidophenyl)sulfonyl-(2-methoxyethyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C17H21N3O6S2 MolecularWeight: 427.49514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CCOC)CC2=NC(=CS2)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CCOC)CC2=NC(=CS2)C(=O)OC

InChI

InChI=1S/C17H21N3O6S2/c1-12(21)18-13-4-6-14(7-5-13)28(23,24)20(8-9-25-2)10-16-19-15(11-27-16)17(22)26-3/h4-7,11H,8-10H2,1-3H3,(H,18,21)