3-[2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]ethyl]-1,3-benzoxazol-2-one Formula: C25H21N3O3S MolecularWeight: 443.51754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCCN4C5=CC=CC=C5OC4=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCCN4C5=CC=CC=C5OC4=O)C

InChI

InChI=1S/C25H21N3O3S/c1-16-13-17(2)15-18(14-16)28-23(29)19-7-3-4-8-20(19)26-24(28)32-12-11-27-21-9-5-6-10-22(21)31-25(27)30/h3-10,13-15H,11-12H2,1-2H3