3-(pyrimidin-2-ylsulfanylmethyl)-1H-quinoxalin-2-one

Systemtic Name: 3-(pyrimidin-2-ylsulfanylmethyl)-1H-quinoxalin-2-one Openeye Name: 3-(pyrimidin-2-ylsulfanylmethyl)-1H-quinoxalin-2-one CAS Name: 3-[(2-pyrimidinylthio)methyl]-1H-quinoxalin-2-one IUPAC Name: 3-(pyrimidin-2-ylsulfanylmethyl)-1H-quinoxalin-2-one Traditional Name: 3-[(2-pyrimidylthio)methyl]-1H-quinoxalin-2-one Formula: C13H10N4OS MolecularWeight: 270.3097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)CSC3=NC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)CSC3=NC=CC=N3

InChI

InChI=1S/C13H10N4OS/c18-12-11(8-19-13-14-6-3-7-15-13)16-9-4-1-2-5-10(9)17-12/h1-7H,8H2,(H,17,18)