3-[(2S)-butan-2-yl]-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[(2S)-butan-2-yl]-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[(1S)-1-methylpropyl]-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[(2S)-butan-2-yl]-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylthio]-4-quinazolinone IUPAC Name: 3-[(2S)-butan-2-yl]-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-[(1S)-1-methylpropyl]-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylthio]quinazolin-4-one Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c1-3-14(2)25-20(26)16-11-7-8-12-17(16)22-21(25)28-13-18-23-24-19(27-18)15-9-5-4-6-10-15/h4-12,14H,3,13H2,1-2H3/t14-/m0/s1