2-[(2R)-3-(3,5-dimethylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one

Systemtic Name: 2-[(2R)-3-(3,5-dimethylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 2-[(2R)-3-(3,5-dimethylphenoxy)-2-hydroxy-propyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 2-[[(2R)-3-(3,5-dimethylphenoxy)-2-hydroxypropyl]thio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 2-[(2R)-3-(3,5-dimethylphenoxy)-2-hydroxypropyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 2-[[(2R)-3-(3,5-dimethylphenoxy)-2-hydroxy-propyl]thio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(CSC2=NC3=CC=CC=C3C(=O)N2CCOC)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC[C@H](CSC2=NC3=CC=CC=C3C(=O)N2CCOC)O)C

InChI

InChI=1S/C22H26N2O4S/c1-15-10-16(2)12-18(11-15)28-13-17(25)14-29-22-23-20-7-5-4-6-19(20)21(26)24(22)8-9-27-3/h4-7,10-12,17,25H,8-9,13-14H2,1-3H3/t17-/m1/s1