5-butyl-3-phenylsulfanyl-4,5-dihydro-1,2-oxazole

Systemtic Name: 5-butyl-3-phenylsulfanyl-4,5-dihydro-1,2-oxazole Openeye Name: 5-butyl-3-phenylsulfanyl-4,5-dihydroisoxazole CAS Name: 5-butyl-3-(phenylthio)-4,5-dihydroisoxazole IUPAC Name: 5-butyl-3-phenylsulfanyl-4,5-dihydro-1,2-oxazole Traditional Name: 5-butyl-3-(phenylthio)-2-isoxazoline Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(=NO1)SC2=CC=CC=C2

Isomeric SMILES

CCCCC1CC(=NO1)SC2=CC=CC=C2

InChI

InChI=1S/C13H17NOS/c1-2-3-7-11-10-13(14-15-11)16-12-8-5-4-6-9-12/h4-6,8-9,11H,2-3,7,10H2,1H3