[4-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]arsonic acid

Systemtic Name: [4-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]arsonic acid Openeye Name: [4-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]arsonic acid CAS Name: [4-[[2-(methylthio)-4-pyrimidinyl]amino]phenyl]arsonic acid IUPAC Name: [4-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]arsonic acid Traditional Name: [4-[[2-(methylthio)pyrimidin-4-yl]amino]phenyl]arsonic acid Formula: C11H12AsN3O3S MolecularWeight: 341.21788

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)NC2=CC=C(C=C2)[As](=O)(O)O

Isomeric SMILES

CSC1=NC=CC(=N1)NC2=CC=C(C=C2)[As](=O)(O)O

InChI

InChI=1S/C11H12AsN3O3S/c1-19-11-13-7-6-10(15-11)14-9-4-2-8(3-5-9)12(16,17)18/h2-7H,1H3,(H,13,14,15)(H2,16,17,18)