S-(4-oxidanylideneazetidin-2-yl) 4-(phenylmethoxycarbonylamino)butanethioate

Systemtic Name: S-(4-oxidanylideneazetidin-2-yl) 4-(phenylmethoxycarbonylamino)butanethioate Openeye Name: S-(4-oxoazetidin-2-yl) 4-(benzyloxycarbonylamino)butanethioate CAS Name: 4-(phenylmethoxycarbonylamino)butanethioic acid S-(4-oxo-2-azetidinyl) ester IUPAC Name: S-(4-oxoazetidin-2-yl) 4-(phenylmethoxycarbonylamino)butanethioate Traditional Name: 4-(benzyloxycarbonylamino)butanethioic acid S-(4-ketoazetidin-2-yl) ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC1=O)SC(=O)CCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1C(NC1=O)SC(=O)CCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C15H18N2O4S/c18-12-9-13(17-12)22-14(19)7-4-8-16-15(20)21-10-11-5-2-1-3-6-11/h1-3,5-6,13H,4,7-10H2,(H,16,20)(H,17,18)