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

Systemtic Name: 2-[(4-aminophenyl)methylsulfanyl]-6-ethyl-pyrimidin-4-olate Openeye Name: 2-[(4-aminophenyl)methylsulfanyl]-6-ethyl-pyrimidin-4-olate CAS Name: 2-[(4-aminophenyl)methylthio]-6-ethyl-4-pyrimidinolate IUPAC Name: 2-[(4-aminophenyl)methylsulfanyl]-6-ethylpyrimidin-4-olate Traditional Name: 2-[(4-aminobenzyl)thio]-6-ethyl-pyrimidin-4-olate Formula: C13H14N3OS- MolecularWeight: 260.33476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)N)[O-]

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)N)[O-]

InChI

InChI=1S/C13H15N3OS/c1-2-11-7-12(17)16-13(15-11)18-8-9-3-5-10(14)6-4-9/h3-7H,2,8,14H2,1H3,(H,15,16,17)/p-1