6-bromanyl-3-[(2-methoxyphenyl)methyl]-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[(2-methoxyphenyl)methyl]-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 6-bromo-3-[(2-methoxyphenyl)methyl]-2-(3-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 6-bromo-3-[(2-methoxyphenyl)methyl]-2-(3-pyridinylmethylthio)-4-quinazolinone IUPAC Name: 6-bromo-3-[(2-methoxyphenyl)methyl]-2-(pyridin-3-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 6-bromo-3-o-anisyl-2-(3-pyridylmethylthio)quinazolin-4-one Formula: C22H18BrN3O2S MolecularWeight: 468.36622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC4=CN=CC=C4

InChI

InChI=1S/C22H18BrN3O2S/c1-28-20-7-3-2-6-16(20)13-26-21(27)18-11-17(23)8-9-19(18)25-22(26)29-14-15-5-4-10-24-12-15/h2-12H,13-14H2,1H3