3-[4-[(2S)-butan-2-yl]phenyl]-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-[(1S)-2-oxidanylidenecyclohexyl]sulfanyl-quinazolin-4-one Openeye Name: 3-[4-[(1S)-1-methylpropyl]phenyl]-2-[(1S)-2-oxocyclohexyl]sulfanyl-quinazolin-4-one CAS Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-[[(1S)-2-oxocyclohexyl]thio]-4-quinazolinone IUPAC Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-[(1S)-2-oxocyclohexyl]sulfanylquinazolin-4-one Traditional Name: 2-[[(1S)-2-ketocyclohexyl]thio]-3-[4-[(1S)-1-methylpropyl]phenyl]quinazolin-4-one Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4CCCCC4=O

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H]4CCCCC4=O

InChI

InChI=1S/C24H26N2O2S/c1-3-16(2)17-12-14-18(15-13-17)26-23(28)19-8-4-5-9-20(19)25-24(26)29-22-11-7-6-10-21(22)27/h4-5,8-9,12-16,22H,3,6-7,10-11H2,1-2H3/t16-,22-/m0/s1