2-[(2-aminophenyl)methylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(2-aminophenyl)methylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(2-aminophenyl)methylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[(2-aminophenyl)methylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(2-aminophenyl)methylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[(2-aminobenzyl)thio]-6-methyl-pyrimidin-4-olate Formula: C12H12N3OS- MolecularWeight: 246.30818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC=C2N)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC=C2N)[O-]

InChI

InChI=1S/C12H13N3OS/c1-8-6-11(16)15-12(14-8)17-7-9-4-2-3-5-10(9)13/h2-6H,7,13H2,1H3,(H,14,15,16)/p-1