2-[(4-tert-butylphenyl)methylsulfanyl]-3-[[(2S)-oxolan-2-yl]methyl]quinazolin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[[(2S)-oxolan-2-yl]methyl]quinazolin-4-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[[(2S)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one CAS Name: 2-[(4-tert-butylphenyl)methylthio]-3-[[(2S)-2-oxolanyl]methyl]-4-quinazolinone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-3-[[(2S)-oxolan-2-yl]methyl]quinazolin-4-one Traditional Name: 2-[(4-tert-butylbenzyl)thio]-3-[[(2S)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one Formula: C24H28N2O2S MolecularWeight: 408.55632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C[C@@H]4CCCO4

InChI

InChI=1S/C24H28N2O2S/c1-24(2,3)18-12-10-17(11-13-18)16-29-23-25-21-9-5-4-8-20(21)22(27)26(23)15-19-7-6-14-28-19/h4-5,8-13,19H,6-7,14-16H2,1-3H3/t19-/m0/s1