3-quinazolin-4-ylsulfanylpentane-2,4-dione

Systemtic Name: 3-quinazolin-4-ylsulfanylpentane-2,4-dione Openeye Name: 3-quinazolin-4-ylsulfanylpentane-2,4-dione CAS Name: 3-(4-quinazolinylthio)pentane-2,4-dione IUPAC Name: 3-quinazolin-4-ylsulfanylpentane-2,4-dione Traditional Name: 3-(quinazolin-4-ylthio)pentane-2,4-dione Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)SC1=NC=NC2=CC=CC=C21

Isomeric SMILES

CC(=O)C(C(=O)C)SC1=NC=NC2=CC=CC=C21

InChI

InChI=1S/C13H12N2O2S/c1-8(16)12(9(2)17)18-13-10-5-3-4-6-11(10)14-7-15-13/h3-7,12H,1-2H3