6-chloranyl-3-(2-methylpropyl)-2-[(2R)-2-oxidanyl-3-phenoxy-propyl]sulfanyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-3-(2-methylpropyl)-2-[(2R)-2-oxidanyl-3-phenoxy-propyl]sulfanyl-quinazolin-4-one Openeye Name: 6-chloro-2-[(2R)-2-hydroxy-3-phenoxy-propyl]sulfanyl-3-isobutyl-quinazolin-4-one CAS Name: 6-chloro-2-[[(2R)-2-hydroxy-3-phenoxypropyl]thio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 6-chloro-2-[(2R)-2-hydroxy-3-phenoxypropyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 6-chloro-2-[[(2R)-2-hydroxy-3-phenoxy-propyl]thio]-3-isobutyl-quinazolin-4-one Formula: C21H23ClN2O3S MolecularWeight: 418.93692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(COC3=CC=CC=C3)O

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SC[C@@H](COC3=CC=CC=C3)O

InChI

InChI=1S/C21H23ClN2O3S/c1-14(2)11-24-20(26)18-10-15(22)8-9-19(18)23-21(24)28-13-16(25)12-27-17-6-4-3-5-7-17/h3-10,14,16,25H,11-13H2,1-2H3/t16-/m1/s1