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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)N2CCN(CC2)C(C)C(C3=CC(=C(C=C3)O)C(=O)OC)O

Isomeric SMILES

CC1=CSC(=N1)N2CCN(CC2)C(C)C(C3=CC(=C(C=C3)O)C(=O)OC)O

InChI

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