6-iodanyl-2-(2-phenoxyethylsulfanyl)-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 6-iodanyl-2-(2-phenoxyethylsulfanyl)-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-6-iodo-2-(2-phenoxyethylsulfanyl)quinazolin-4-one CAS Name: 6-iodo-2-(2-phenoxyethylthio)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-6-iodo-2-(2-phenoxyethylsulfanyl)quinazolin-4-one Traditional Name: 3-benzyl-6-iodo-2-(2-phenoxyethylthio)quinazolin-4-one Formula: C23H19IN2O2S MolecularWeight: 514.37863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCCOC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCCOC4=CC=CC=C4

InChI

InChI=1S/C23H19IN2O2S/c24-18-11-12-21-20(15-18)22(27)26(16-17-7-3-1-4-8-17)23(25-21)29-14-13-28-19-9-5-2-6-10-19/h1-12,15H,13-14,16H2