4-[2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanylacetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-(4-amino-6-methylpyrimidin-2-yl)sulfanylacetyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2C3=CC=CC=C3NC(=O)C2(C)C)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2C3=CC=CC=C3NC(=O)C2(C)C)N

InChI

InChI=1S/C17H19N5O2S/c1-10-8-13(18)21-16(19-10)25-9-14(23)22-12-7-5-4-6-11(12)20-15(24)17(22,2)3/h4-8H,9H2,1-3H3,(H,20,24)(H2,18,19,21)