3,3-dimethyl-4-[2-(2-methylquinazolin-4-yl)sulfanylethanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-(2-methylquinazolin-4-yl)sulfanylethanoyl]-1H-quinoxalin-2-one Openeye Name: 3,3-dimethyl-4-[2-(2-methylquinazolin-4-yl)sulfanylacetyl]-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[2-[(2-methyl-4-quinazolinyl)thio]-1-oxoethyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[2-(2-methylquinazolin-4-yl)sulfanylacetyl]-1H-quinoxalin-2-one Traditional Name: 3,3-dimethyl-4-[2-[(2-methylquinazolin-4-yl)thio]acetyl]-1H-quinoxalin-2-one Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

InChI

InChI=1S/C21H20N4O2S/c1-13-22-15-9-5-4-8-14(15)19(23-13)28-12-18(26)25-17-11-7-6-10-16(17)24-20(27)21(25,2)3/h4-11H,12H2,1-3H3,(H,24,27)