3-[(4-bromophenyl)sulfanylmethyl]-5-phenyl-1,2-oxazole

Systemtic Name: 3-[(4-bromophenyl)sulfanylmethyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[(4-bromophenyl)sulfanylmethyl]-5-phenyl-isoxazole CAS Name: 3-[[(4-bromophenyl)thio]methyl]-5-phenylisoxazole IUPAC Name: 3-[(4-bromophenyl)sulfanylmethyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[[(4-bromophenyl)thio]methyl]-5-phenyl-isoxazole Formula: C16H12BrNOS MolecularWeight: 346.24158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H12BrNOS/c17-13-6-8-15(9-7-13)20-11-14-10-16(19-18-14)12-4-2-1-3-5-12/h1-10H,11H2