(2-phenyl-1,3-thiazol-4-yl)methyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid (2-phenylthiazol-4-yl)methyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O4S/c24-19-10-11-26-18-9-5-4-8-17(18)23(19)12-20(25)27-13-16-14-28-21(22-16)15-6-2-1-3-7-15/h1-9,14H,10-13H2