4'-(4-methylphenyl)-3'-phenyl-spiro[1H-isothiochromene-3,5'-4H-1,2-oxazole]-4-one

Systemtic Name: 4'-(4-methylphenyl)-3'-phenyl-spiro[1H-isothiochromene-3,5'-4H-1,2-oxazole]-4-one Openeye Name: 3-phenyl-4-(p-tolyl)spiro[4H-isoxazole-5,3'-isothiochromane]-4'-one CAS Name: 4'-(4-methylphenyl)-3'-phenyl-4-spiro[1H-2-benzothiopyran-3,5'-4H-isoxazole]one IUPAC Name: 4'-(4-methylphenyl)-3'-phenylspiro[1H-isothiochromene-3,5'-4H-1,2-oxazole]-4-one Traditional Name: 3-phenyl-4-(p-tolyl)spiro[2-isoxazoline-5,3'-isothiochroman]-4'-one Formula: C24H19NO2S MolecularWeight: 385.47816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=NOC23C(=O)C4=CC=CC=C4CS3)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=NOC23C(=O)C4=CC=CC=C4CS3)C5=CC=CC=C5

InChI

InChI=1S/C24H19NO2S/c1-16-11-13-17(14-12-16)21-22(18-7-3-2-4-8-18)25-27-24(21)23(26)20-10-6-5-9-19(20)15-28-24/h2-14,21H,15H2,1H3