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

Systemtic Name: [4-[[4-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]diazenyl]phenyl]arsonic acid Openeye Name: [4-[4-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]azophenyl]arsonic acid CAS Name: [4-[4-[[2-(methylthio)-4-pyrimidinyl]amino]phenyl]azophenyl]arsonic acid IUPAC Name: [4-[[4-[(2-methylsulfanylpyrimidin-4-yl)amino]phenyl]diazenyl]phenyl]arsonic acid Traditional Name: [4-[4-[[2-(methylthio)pyrimidin-4-yl]amino]phenyl]azophenyl]arsonic acid Formula: C17H16AsN5O3S MolecularWeight: 445.32724

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)[As](=O)(O)O

Isomeric SMILES

CSC1=NC=CC(=N1)NC2=CC=C(C=C2)N=NC3=CC=C(C=C3)[As](=O)(O)O

InChI

InChI=1S/C17H16AsN5O3S/c1-27-17-19-11-10-16(21-17)20-13-6-8-15(9-7-13)23-22-14-4-2-12(3-5-14)18(24,25)26/h2-11H,1H3,(H,19,20,21)(H2,24,25,26)