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

Systemtic Name: 2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O2S/c1-2-5-10-8-14(21)20-16(17-10)23-9-13-18-12-7-4-3-6-11(12)15(22)19-13/h3-4,6-8H,2,5,9H2,1H3,(H,17,20,21)(H,18,19,22)