ethyl 5-[2-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-1-oxidanyl-ethyl]-2-oxidanyl-benzoate

Systemtic Name: ethyl 5-[2-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-1-oxidanyl-ethyl]-2-oxidanyl-benzoate Openeye Name: ethyl 2-hydroxy-5-[1-hydroxy-2-[4-(4-methylthiazol-2-yl)piperazin-1-yl]ethyl]benzoate CAS Name: 2-hydroxy-5-[1-hydroxy-2-[4-(4-methyl-2-thiazolyl)-1-piperazinyl]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-5-[1-hydroxy-2-[4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]ethyl]benzoate Traditional Name: 2-hydroxy-5-[1-hydroxy-2-[4-(4-methylthiazol-2-yl)piperazino]ethyl]benzoic acid ethyl ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)C(CN2CCN(CC2)C3=NC(=CS3)C)O)O

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)C(CN2CCN(CC2)C3=NC(=CS3)C)O)O

InChI

InChI=1S/C19H25N3O4S/c1-3-26-18(25)15-10-14(4-5-16(15)23)17(24)11-21-6-8-22(9-7-21)19-20-13(2)12-27-19/h4-5,10,12,17,23-24H,3,6-9,11H2,1-2H3