5-(isothiocyanatomethyl)-3-phenyl-4,5-dihydro-1,2-oxazole

Systemtic Name: 5-(isothiocyanatomethyl)-3-phenyl-4,5-dihydro-1,2-oxazole Openeye Name: 5-(isothiocyanatomethyl)-3-phenyl-4,5-dihydroisoxazole CAS Name: 5-(isothiocyanatomethyl)-3-phenyl-4,5-dihydroisoxazole IUPAC Name: 5-(isothiocyanatomethyl)-3-phenyl-4,5-dihydro-1,2-oxazole Traditional Name: 5-(isothiocyanatomethyl)-3-phenyl-2-isoxazoline Formula: C11H10N2OS MolecularWeight: 218.2749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC=CC=C2)CN=C=S

Isomeric SMILES

C1C(ON=C1C2=CC=CC=C2)CN=C=S

InChI

InChI=1S/C11H10N2OS/c15-8-12-7-10-6-11(13-14-10)9-4-2-1-3-5-9/h1-5,10H,6-7H2