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

Systemtic Name: 2-methylpropyl (2S)-2-[4-(2-azanyl-5-methyl-1,3-thiazol-4-yl)phenoxy]butanoate Openeye Name: isobutyl (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 2-methylpropyl ester IUPAC Name: 2-methylpropyl (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 isobutyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O3S/c1-5-15(17(21)22-10-11(2)3)23-14-8-6-13(7-9-14)16-12(4)24-18(19)20-16/h6-9,11,15H,5,10H2,1-4H3,(H2,19,20)/t15-/m0/s1