3-[4-[(2S)-butan-2-yl]phenyl]-2-(3-oxidanylidenebutylsulfanyl)quinazolin-4-one

Systemtic Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-(3-oxidanylidenebutylsulfanyl)quinazolin-4-one Openeye Name: 3-[4-[(1S)-1-methylpropyl]phenyl]-2-(3-oxobutylsulfanyl)quinazolin-4-one CAS Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-(3-oxobutylthio)-4-quinazolinone IUPAC Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-(3-oxobutylsulfanyl)quinazolin-4-one Traditional Name: 2-(3-ketobutylthio)-3-[4-[(1S)-1-methylpropyl]phenyl]quinazolin-4-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC(=O)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC(=O)C

InChI

InChI=1S/C22H24N2O2S/c1-4-15(2)17-9-11-18(12-10-17)24-21(26)19-7-5-6-8-20(19)23-22(24)27-14-13-16(3)25/h5-12,15H,4,13-14H2,1-3H3/t15-/m0/s1