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

Systemtic Name: methyl 4-[2-[[2-oxidanyl-2-(1,3-thiazol-4-yl)ethyl]amino]propyl]benzoate Openeye Name: methyl 4-[2-[(2-hydroxy-2-thiazol-4-yl-ethyl)amino]propyl]benzoate CAS Name: 4-[2-[[2-hydroxy-2-(4-thiazolyl)ethyl]amino]propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-hydroxy-2-(1,3-thiazol-4-yl)ethyl]amino]propyl]benzoate Traditional Name: 4-[2-[(2-hydroxy-2-thiazol-4-yl-ethyl)amino]propyl]benzoic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(=O)OC)NCC(C2=CSC=N2)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)C(=O)OC)NCC(C2=CSC=N2)O

InChI

InChI=1S/C16H20N2O3S/c1-11(17-8-15(19)14-9-22-10-18-14)7-12-3-5-13(6-4-12)16(20)21-2/h3-6,9-11,15,17,19H,7-8H2,1-2H3