ethyl (2S)-2-[4-(2-azanyl-5-methyl-1,3-thiazol-4-yl)phenoxy]butanoate

Systemtic Name: ethyl (2S)-2-[4-(2-azanyl-5-methyl-1,3-thiazol-4-yl)phenoxy]butanoate Openeye Name: ethyl (2S)-2-[4-(2-amino-5-methyl-thiazol-4-yl)phenoxy]butanoate CAS Name: (2S)-2-[4-(2-amino-5-methyl-4-thiazolyl)phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[4-(2-amino-5-methyl-1,3-thiazol-4-yl)phenoxy]butanoate Traditional Name: (2S)-2-[4-(2-amino-5-methyl-thiazol-4-yl)phenoxy]butyric acid ethyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)OC1=CC=C(C=C1)C2=C(SC(=N2)N)C

Isomeric SMILES

CC[C@@H](C(=O)OCC)OC1=CC=C(C=C1)C2=C(SC(=N2)N)C

InChI

InChI=1S/C16H20N2O3S/c1-4-13(15(19)20-5-2)21-12-8-6-11(7-9-12)14-10(3)22-16(17)18-14/h6-9,13H,4-5H2,1-3H3,(H2,17,18)/t13-/m0/s1