O-phenyl 4-bromanyl-5-oxidanylidene-3-phenyl-1,2-oxazole-2-carbothioate

Systemtic Name: O-phenyl 4-bromanyl-5-oxidanylidene-3-phenyl-1,2-oxazole-2-carbothioate Openeye Name: O-phenyl 4-bromo-5-oxo-3-phenyl-isoxazole-2-carbothioate CAS Name: 4-bromo-5-oxo-3-phenyl-2-isoxazolecarbothioic acid O-phenyl ester IUPAC Name: O-phenyl 4-bromo-5-oxo-3-phenyl-1,2-oxazole-2-carbothioate Traditional Name: 4-bromo-5-keto-3-phenyl-3-isoxazoline-2-carbothioic acid O-phenyl ester Formula: C16H10BrNO3S MolecularWeight: 376.2245

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)ON2C(=S)OC3=CC=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)ON2C(=S)OC3=CC=CC=C3)Br

InChI

InChI=1S/C16H10BrNO3S/c17-13-14(11-7-3-1-4-8-11)18(21-15(13)19)16(22)20-12-9-5-2-6-10-12/h1-10H