6-iodanyl-3-(phenylmethyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(phenylmethyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-benzyl-6-iodo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 6-iodo-3-(phenylmethyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylthio]-4-quinazolinone IUPAC Name: 3-benzyl-6-iodo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-benzyl-6-iodo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylthio]quinazolin-4-one Formula: C24H17IN4O2S MolecularWeight: 552.38685

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC4=NN=C(O4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC4=NN=C(O4)C5=CC=CC=C5

InChI

InChI=1S/C24H17IN4O2S/c25-18-11-12-20-19(13-18)23(30)29(14-16-7-3-1-4-8-16)24(26-20)32-15-21-27-28-22(31-21)17-9-5-2-6-10-17/h1-13H,14-15H2