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

Systemtic Name: 5-(isothiocyanatomethyl)-3-(4-phenylphenyl)-4,5-dihydro-1,2-oxazole Openeye Name: 5-(isothiocyanatomethyl)-3-(4-phenylphenyl)-4,5-dihydroisoxazole CAS Name: 5-(isothiocyanatomethyl)-3-(4-phenylphenyl)-4,5-dihydroisoxazole IUPAC Name: 5-(isothiocyanatomethyl)-3-(4-phenylphenyl)-4,5-dihydro-1,2-oxazole Traditional Name: 5-(isothiocyanatomethyl)-3-(4-phenylphenyl)-2-isoxazoline Formula: C17H14N2OS MolecularWeight: 294.37086

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC=C(C=C2)C3=CC=CC=C3)CN=C=S

Isomeric SMILES

C1C(ON=C1C2=CC=C(C=C2)C3=CC=CC=C3)CN=C=S

InChI

InChI=1S/C17H14N2OS/c21-12-18-11-16-10-17(19-20-16)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,16H,10-11H2