4-[2-[2-(phenylmethyl)quinazolin-4-yl]sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[2-(phenylmethyl)quinazolin-4-yl]sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-(2-benzylquinazolin-4-yl)sulfanylacetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[1-oxo-2-[[2-(phenylmethyl)-4-quinazolinyl]thio]ethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-(2-benzylquinazolin-4-yl)sulfanylacetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(2-benzylquinazolin-4-yl)thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC(=NC4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC(=NC4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C25H20N4O2S/c30-23-15-29(21-13-7-6-12-20(21)27-23)24(31)16-32-25-18-10-4-5-11-19(18)26-22(28-25)14-17-8-2-1-3-9-17/h1-13H,14-16H2,(H,27,30)