7-bromanyl-6-chloranyl-3-[2-oxidanylidene-3-[(2R,3S)-3-oxidanylthiolan-2-yl]propyl]quinazolin-4-one

Systemtic Name: 7-bromanyl-6-chloranyl-3-[2-oxidanylidene-3-[(2R,3S)-3-oxidanylthiolan-2-yl]propyl]quinazolin-4-one Openeye Name: 7-bromo-6-chloro-3-[3-[(2R,3S)-3-hydroxytetrahydrothiophen-2-yl]-2-oxo-propyl]quinazolin-4-one CAS Name: 7-bromo-6-chloro-3-[3-[(2R,3S)-3-hydroxy-2-thiolanyl]-2-oxopropyl]-4-quinazolinone IUPAC Name: 7-bromo-6-chloro-3-[3-[(2R,3S)-3-hydroxythiolan-2-yl]-2-oxopropyl]quinazolin-4-one Traditional Name: 7-bromo-6-chloro-3-[3-[(2R,3S)-3-hydroxytetrahydrothiophen-2-yl]-2-keto-propyl]quinazolin-4-one Formula: C15H14BrClN2O3S MolecularWeight: 417.70526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(C1O)CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br

Isomeric SMILES

C1CS[C@@H]([C@H]1O)CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br

InChI

InChI=1S/C15H14BrClN2O3S/c16-10-5-12-9(4-11(10)17)15(22)19(7-18-12)6-8(20)3-14-13(21)1-2-23-14/h4-5,7,13-14,21H,1-3,6H2/t13-,14+/m0/s1