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

Systemtic Name: 2-[1-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[1-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[1-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[1-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]ethyl]-1H-quinazolin-4-one Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H18N4O2S/c1-3-6-11-9-14(22)20-17(18-11)24-10(2)15-19-13-8-5-4-7-12(13)16(23)21-15/h4-5,7-10H,3,6H2,1-2H3,(H,18,20,22)(H,19,21,23)