3-ethyl-6-iodanyl-2-phenethylsulfanyl-quinazolin-4-one

Systemtic Name: 3-ethyl-6-iodanyl-2-phenethylsulfanyl-quinazolin-4-one Openeye Name: 3-ethyl-6-iodo-2-phenethylsulfanyl-quinazolin-4-one CAS Name: 3-ethyl-6-iodo-2-(phenethylthio)-4-quinazolinone IUPAC Name: 3-ethyl-6-iodo-2-phenethylsulfanylquinazolin-4-one Traditional Name: 3-ethyl-6-iodo-2-(phenethylthio)quinazolin-4-one Formula: C18H17IN2OS MolecularWeight: 436.30985

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)I)N=C1SCCC3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)I)N=C1SCCC3=CC=CC=C3

InChI

InChI=1S/C18H17IN2OS/c1-2-21-17(22)15-12-14(19)8-9-16(15)20-18(21)23-11-10-13-6-4-3-5-7-13/h3-9,12H,2,10-11H2,1H3