5-phenyl-3-[(phenylmethylsulfanyl)methyl]-1,2-oxazole

Systemtic Name: 5-phenyl-3-[(phenylmethylsulfanyl)methyl]-1,2-oxazole Openeye Name: 3-(benzylsulfanylmethyl)-5-phenyl-isoxazole CAS Name: 5-phenyl-3-[(phenylmethylthio)methyl]isoxazole IUPAC Name: 3-(benzylsulfanylmethyl)-5-phenyl-1,2-oxazole Traditional Name: 3-[(benzylthio)methyl]-5-phenyl-isoxazole Formula: C17H15NOS MolecularWeight: 281.3721

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=NOC(=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=NOC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H15NOS/c1-3-7-14(8-4-1)12-20-13-16-11-17(19-18-16)15-9-5-2-6-10-15/h1-11H,12-13H2