(E)-6-oxidanylidene-6-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]hex-2-enoic acid

Systemtic Name: (E)-6-oxidanylidene-6-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]hex-2-enoic acid Openeye Name: (E)-6-benzyloxy-2-[2-(benzyloxycarbonylamino)thiazol-4-yl]-6-oxo-hex-2-enoic acid CAS Name: (E)-6-oxo-6-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-4-thiazolyl]-2-hexenoic acid IUPAC Name: (E)-6-oxo-6-phenylmethoxy-2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]hex-2-enoic acid Traditional Name: (E)-6-benzoxy-2-[2-(benzyloxycarbonylamino)thiazol-4-yl]-6-keto-hex-2-enoic acid Formula: C24H22N2O6S MolecularWeight: 466.50628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC=C(C2=CSC(=N2)NC(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CC/C=C(\C2=CSC(=N2)NC(=O)OCC3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C24H22N2O6S/c27-21(31-14-17-8-3-1-4-9-17)13-7-12-19(22(28)29)20-16-33-23(25-20)26-24(30)32-15-18-10-5-2-6-11-18/h1-6,8-12,16H,7,13-15H2,(H,28,29)(H,25,26,30)/b19-12+