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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(COC3=C(C=CC(=C3C)C)C)O

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SC[C@H](COC3=C(C=CC(=C3C)C)C)O

InChI

InChI=1S/C23H28N2O3S/c1-5-12-25-22(27)19-8-6-7-9-20(19)24-23(25)29-14-18(26)13-28-21-16(3)11-10-15(2)17(21)4/h6-11,18,26H,5,12-14H2,1-4H3/t18-/m0/s1