6-iodanyl-3-(2-methoxyphenyl)-2-(phenylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(2-methoxyphenyl)-2-(phenylmethylsulfanyl)quinazolin-4-one Openeye Name: 2-benzylsulfanyl-6-iodo-3-(2-methoxyphenyl)quinazolin-4-one CAS Name: 6-iodo-3-(2-methoxyphenyl)-2-(phenylmethylthio)-4-quinazolinone IUPAC Name: 2-benzylsulfanyl-6-iodo-3-(2-methoxyphenyl)quinazolin-4-one Traditional Name: 2-(benzylthio)-6-iodo-3-(2-methoxyphenyl)quinazolin-4-one Formula: C22H17IN2O2S MolecularWeight: 500.35205

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C22H17IN2O2S/c1-27-20-10-6-5-9-19(20)25-21(26)17-13-16(23)11-12-18(17)24-22(25)28-14-15-7-3-2-4-8-15/h2-13H,14H2,1H3