4-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[1-(benzyloxycarbonylamino)-3-methyl-butyl]thiazole-2-carboxylic acid CAS Name: 4-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[3-methyl-1-(phenylmethoxycarbonylamino)butyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[1-(benzyloxycarbonylamino)-3-methyl-butyl]thiazole-2-carboxylic acid Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CSC(=N1)C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C1=CSC(=N1)C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O4S/c1-11(2)8-13(14-10-24-15(18-14)16(20)21)19-17(22)23-9-12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3,(H,19,22)(H,20,21)