3-[(3-azanylpyridin-4-yl)sulfanylmethyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[(3-azanylpyridin-4-yl)sulfanylmethyl]-1H-quinoxalin-2-one Openeye Name: 3-[(3-amino-4-pyridyl)sulfanylmethyl]-1H-quinoxalin-2-one CAS Name: 3-[[(3-amino-4-pyridinyl)thio]methyl]-1H-quinoxalin-2-one IUPAC Name: 3-[(3-aminopyridin-4-yl)sulfanylmethyl]-1H-quinoxalin-2-one Traditional Name: 3-[[(3-amino-4-pyridyl)thio]methyl]-1H-quinoxalin-2-one Formula: C14H12N4OS MolecularWeight: 284.33628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)CSC3=C(C=NC=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)CSC3=C(C=NC=C3)N

InChI

InChI=1S/C14H12N4OS/c15-9-7-16-6-5-13(9)20-8-12-14(19)18-11-4-2-1-3-10(11)17-12/h1-7H,8,15H2,(H,18,19)