2-[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[(1S)-1-(benzyloxycarbonylamino)-2-phenyl-ethyl]thiazole-4-carboxylic acid CAS Name: 2-[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[(1S)-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[(1S)-1-(benzyloxycarbonylamino)-2-phenyl-ethyl]thiazole-4-carboxylic acid Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=NC(=CS2)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C2=NC(=CS2)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O4S/c23-19(24)17-13-27-18(21-17)16(11-14-7-3-1-4-8-14)22-20(25)26-12-15-9-5-2-6-10-15/h1-10,13,16H,11-12H2,(H,22,25)(H,23,24)/t16-/m0/s1