6,8-bis(bromanyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6,8-bis(bromanyl)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6,8-dibromo-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6,8-dibromo-2-[[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6,8-dibromo-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6,8-dibromo-2-[[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C16H14Br2N4O2S MolecularWeight: 486.18096

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

InChI

InChI=1S/C16H14Br2N4O2S/c1-2-3-9-6-13(23)22-16(19-9)25-7-12-20-14-10(15(24)21-12)4-8(17)5-11(14)18/h4-6H,2-3,7H2,1H3,(H,19,22,23)(H,20,21,24)