2-[(2R)-2-oxidanyl-3-(2,3,6-trimethylphenoxy)propyl]sulfanyl-3-propan-2-yl-quinazolin-4-one

Systemtic Name: 2-[(2R)-2-oxidanyl-3-(2,3,6-trimethylphenoxy)propyl]sulfanyl-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-[(2R)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]sulfanyl-3-isopropyl-quinazolin-4-one CAS Name: 2-[[(2R)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]thio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[(2R)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]sulfanyl-3-propan-2-ylquinazolin-4-one Traditional Name: 2-[[(2R)-2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]thio]-3-isopropyl-quinazolin-4-one Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(CSC2=NC3=CC=CC=C3C(=O)N2C(C)C)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC[C@H](CSC2=NC3=CC=CC=C3C(=O)N2C(C)C)O)C

InChI

InChI=1S/C23H28N2O3S/c1-14(2)25-22(27)19-8-6-7-9-20(19)24-23(25)29-13-18(26)12-28-21-16(4)11-10-15(3)17(21)5/h6-11,14,18,26H,12-13H2,1-5H3/t18-/m1/s1