2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-3-propan-2-yl-quinazolin-4-one

Systemtic Name: 2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-[(2-bromo-4,5-dimethoxy-phenyl)methylsulfanyl]-3-isopropyl-quinazolin-4-one CAS Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[(2-bromo-4,5-dimethoxyphenyl)methylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 2-[(2-bromo-4,5-dimethoxy-benzyl)thio]-3-isopropyl-quinazolin-4-one Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C20H21BrN2O3S/c1-12(2)23-19(24)14-7-5-6-8-16(14)22-20(23)27-11-13-9-17(25-3)18(26-4)10-15(13)21/h5-10,12H,11H2,1-4H3