3,3-dimethyl-4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanoyl]-1H-quinoxalin-2-one Openeye Name: 3,3-dimethyl-4-[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[1-oxo-2-[(4-oxo-1H-quinazolin-2-yl)thio]ethyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetyl]-1H-quinoxalin-2-one Traditional Name: 4-[2-[(4-keto-1H-quinazolin-2-yl)thio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC(=O)C4=CC=CC=C4N3)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC(=O)C4=CC=CC=C4N3)C

InChI

InChI=1S/C20H18N4O3S/c1-20(2)18(27)21-14-9-5-6-10-15(14)24(20)16(25)11-28-19-22-13-8-4-3-7-12(13)17(26)23-19/h3-10H,11H2,1-2H3,(H,21,27)(H,22,23,26)