methyl (2S)-4-methyl-2-[[4-(1,3-thiazol-4-ylmethoxy)phenyl]carbonylamino]pentanoate

Systemtic Name: methyl (2S)-4-methyl-2-[[4-(1,3-thiazol-4-ylmethoxy)phenyl]carbonylamino]pentanoate Openeye Name: methyl (2S)-4-methyl-2-[[4-(thiazol-4-ylmethoxy)benzoyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-[4-(4-thiazolylmethoxy)phenyl]methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-4-methyl-2-[[4-(1,3-thiazol-4-ylmethoxy)benzoyl]amino]pentanoate Traditional Name: (2S)-4-methyl-2-[[4-(thiazol-4-ylmethoxy)benzoyl]amino]valeric acid methyl ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CC=C(C=C1)OCC2=CSC=N2

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)C1=CC=C(C=C1)OCC2=CSC=N2

InChI

InChI=1S/C18H22N2O4S/c1-12(2)8-16(18(22)23-3)20-17(21)13-4-6-15(7-5-13)24-9-14-10-25-11-19-14/h4-7,10-12,16H,8-9H2,1-3H3,(H,20,21)/t16-/m0/s1