2-[(2R)-3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[(2R)-3-(4-tert-butylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(2R)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[(2R)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(2R)-3-(4-tert-butylphenoxy)-2-hydroxypropyl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[[(2R)-3-(4-tert-butylphenoxy)-2-hydroxy-propyl]thio]quinazolin-4-one Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(CSC2=NC3=CC=CC=C3C(=O)N2CC=C)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC[C@H](CSC2=NC3=CC=CC=C3C(=O)N2CC=C)O

InChI

InChI=1S/C24H28N2O3S/c1-5-14-26-22(28)20-8-6-7-9-21(20)25-23(26)30-16-18(27)15-29-19-12-10-17(11-13-19)24(2,3)4/h5-13,18,27H,1,14-16H2,2-4H3/t18-/m1/s1