2-[(2R)-3-(2-methylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one

Systemtic Name: 2-[(2R)-3-(2-methylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one Openeye Name: 2-[(2R)-2-hydroxy-3-(2-methylphenoxy)propyl]sulfanyl-3-isobutyl-quinazolin-4-one CAS Name: 2-[[(2R)-2-hydroxy-3-(2-methylphenoxy)propyl]thio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 2-[(2R)-2-hydroxy-3-(2-methylphenoxy)propyl]sulfanyl-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 2-[[(2R)-2-hydroxy-3-(2-methylphenoxy)propyl]thio]-3-isobutyl-quinazolin-4-one Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C)O

Isomeric SMILES

CC1=CC=CC=C1OC[C@H](CSC2=NC3=CC=CC=C3C(=O)N2CC(C)C)O

InChI

InChI=1S/C22H26N2O3S/c1-15(2)12-24-21(26)18-9-5-6-10-19(18)23-22(24)28-14-17(25)13-27-20-11-7-4-8-16(20)3/h4-11,15,17,25H,12-14H2,1-3H3/t17-/m1/s1