3,3-dimethyl-4-(2-quinazolin-4-ylsulfanylethanoyl)-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-(2-quinazolin-4-ylsulfanylethanoyl)-1H-quinoxalin-2-one Openeye Name: 3,3-dimethyl-4-(2-quinazolin-4-ylsulfanylacetyl)-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[1-oxo-2-(4-quinazolinylthio)ethyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-(2-quinazolin-4-ylsulfanylacetyl)-1H-quinoxalin-2-one Traditional Name: 3,3-dimethyl-4-[2-(quinazolin-4-ylthio)acetyl]-1H-quinoxalin-2-one Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC=NC4=CC=CC=C43)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC=NC4=CC=CC=C43)C

InChI

InChI=1S/C20H18N4O2S/c1-20(2)19(26)23-15-9-5-6-10-16(15)24(20)17(25)11-27-18-13-7-3-4-8-14(13)21-12-22-18/h3-10,12H,11H2,1-2H3,(H,23,26)