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

Systemtic Name: ethyl 2-[[(4-acetamidophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-acetamidophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[(4-acetamidophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-acetamidophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-acetamidophenyl)sulfonyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C19H25N3O6S2 MolecularWeight: 455.5483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(CCCOC)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(CCCOC)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C19H25N3O6S2/c1-4-28-19(24)17-13-29-18(21-17)12-22(10-5-11-27-3)30(25,26)16-8-6-15(7-9-16)20-14(2)23/h6-9,13H,4-5,10-12H2,1-3H3,(H,20,23)