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

Systemtic Name: 2-[(2R)-3-(4-methylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]thio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]sulfanyl-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[[(2R)-2-hydroxy-3-(4-methylphenoxy)propyl]thio]quinazolin-4-one Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(CSC2=NC3=CC=CC=C3C(=O)N2CC=C)O

Isomeric SMILES

CC1=CC=C(C=C1)OC[C@H](CSC2=NC3=CC=CC=C3C(=O)N2CC=C)O

InChI

InChI=1S/C21H22N2O3S/c1-3-12-23-20(25)18-6-4-5-7-19(18)22-21(23)27-14-16(24)13-26-17-10-8-15(2)9-11-17/h3-11,16,24H,1,12-14H2,2H3/t16-/m1/s1