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

Systemtic Name: ethyl 4-[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-3-azanyl-4-oxidanyl-butyl]benzoate Openeye Name: ethyl 4-[4-(2-acetamido-4-methyl-thiazol-5-yl)-3-amino-4-hydroxy-butyl]benzoate CAS Name: 4-[4-(2-acetamido-4-methyl-5-thiazolyl)-3-amino-4-hydroxybutyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-acetamido-4-methyl-1,3-thiazol-5-yl)-3-amino-4-hydroxybutyl]benzoate Traditional Name: 4-[4-(2-acetamido-4-methyl-thiazol-5-yl)-3-amino-4-hydroxy-butyl]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)CCC(C(C2=C(N=C(S2)NC(=O)C)C)O)N

Isomeric SMILES

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

InChI

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