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

Systemtic Name: 2-[(4-aminophenyl)methylsulfanyl]-6-tert-butyl-pyrimidin-4-olate Openeye Name: 2-[(4-aminophenyl)methylsulfanyl]-6-tert-butyl-pyrimidin-4-olate CAS Name: 2-[(4-aminophenyl)methylthio]-6-tert-butyl-4-pyrimidinolate IUPAC Name: 2-[(4-aminophenyl)methylsulfanyl]-6-tert-butylpyrimidin-4-olate Traditional Name: 2-[(4-aminobenzyl)thio]-6-tert-butyl-pyrimidin-4-olate Formula: C15H18N3OS- MolecularWeight: 288.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)N)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)N)[O-]

InChI

InChI=1S/C15H19N3OS/c1-15(2,3)12-8-13(19)18-14(17-12)20-9-10-4-6-11(16)7-5-10/h4-8H,9,16H2,1-3H3,(H,17,18,19)/p-1