2-[(2R)-3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one

Systemtic Name: 2-[(2R)-3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 2-[(2R)-3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 2-[[(2R)-3-(2,6-dimethylphenoxy)-2-hydroxypropyl]thio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 2-[(2R)-3-(2,6-dimethylphenoxy)-2-hydroxypropyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 2-[[(2R)-3-(2,6-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=C(C(=CC=C1)C)OCC(CSC2=NC3=CC=CC=C3C(=O)N2CCOC)O

Isomeric SMILES

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

InChI

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