3-butyl-2-phenacylsulfanyl-quinazolin-4-one

Systemtic Name: 3-butyl-2-phenacylsulfanyl-quinazolin-4-one Openeye Name: 3-butyl-2-phenacylsulfanyl-quinazolin-4-one CAS Name: 3-butyl-2-(phenacylthio)-4-quinazolinone IUPAC Name: 3-butyl-2-phenacylsulfanylquinazolin-4-one Traditional Name: 3-butyl-2-(phenacylthio)quinazolin-4-one Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2S/c1-2-3-13-22-19(24)16-11-7-8-12-17(16)21-20(22)25-14-18(23)15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3