1-[4-[(2R)-2-oxidanyl-3-quinazolin-4-ylsulfanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[(2R)-2-oxidanyl-3-quinazolin-4-ylsulfanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[(2R)-2-hydroxy-3-quinazolin-4-ylsulfanyl-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[(2R)-2-hydroxy-3-(4-quinazolinylthio)propoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[(2R)-2-hydroxy-3-quinazolin-4-ylsulfanylpropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[(2R)-2-hydroxy-3-(quinazolin-4-ylthio)propoxy]phenyl]propan-1-one Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CSC2=NC=NC3=CC=CC=C32)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC[C@H](CSC2=NC=NC3=CC=CC=C32)O

InChI

InChI=1S/C20H20N2O3S/c1-2-19(24)14-7-9-16(10-8-14)25-11-15(23)12-26-20-17-5-3-4-6-18(17)21-13-22-20/h3-10,13,15,23H,2,11-12H2,1H3/t15-/m1/s1