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

Systemtic Name: 3-[(2S)-butan-2-yl]-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[(1S)-1-methylpropyl]-2-[(5-phenyloxazol-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[(2S)-butan-2-yl]-2-[(5-phenyl-2-oxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-[(2S)-butan-2-yl]-2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-[(1S)-1-methylpropyl]-2-[(5-phenyloxazol-2-yl)methylthio]quinazolin-4-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O2S/c1-3-15(2)25-21(26)17-11-7-8-12-18(17)24-22(25)28-14-20-23-13-19(27-20)16-9-5-4-6-10-16/h4-13,15H,3,14H2,1-2H3/t15-/m0/s1