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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CCNCC(C2=C(N=C(S2)NC(=O)C)C)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CCNCC(C2=C(N=C(S2)NC(=O)C)C)O

InChI

InChI=1S/C19H25N3O4S/c1-4-26-18(25)15-7-5-14(6-8-15)9-10-20-11-16(24)17-12(2)21-19(27-17)22-13(3)23/h5-8,16,20,24H,4,9-11H2,1-3H3,(H,21,22,23)