7-iodanyl-3-[3-(3-methoxypiperidin-2-yl)-2-oxidanylidene-propyl]-6-methylsulfanyl-quinazolin-4-one

Systemtic Name: 7-iodanyl-3-[3-(3-methoxypiperidin-2-yl)-2-oxidanylidene-propyl]-6-methylsulfanyl-quinazolin-4-one Openeye Name: 7-iodo-3-[3-(3-methoxy-2-piperidyl)-2-oxo-propyl]-6-methylsulfanyl-quinazolin-4-one CAS Name: 7-iodo-3-[3-(3-methoxy-2-piperidinyl)-2-oxopropyl]-6-(methylthio)-4-quinazolinone IUPAC Name: 7-iodo-3-[3-(3-methoxypiperidin-2-yl)-2-oxopropyl]-6-methylsulfanylquinazolin-4-one Traditional Name: 7-iodo-3-[2-keto-3-(3-methoxy-2-piperidyl)propyl]-6-(methylthio)quinazolin-4-one Formula: C18H22IN3O3S MolecularWeight: 487.35505

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCNC1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)SC)I

Isomeric SMILES

COC1CCCNC1CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)SC)I

InChI

InChI=1S/C18H22IN3O3S/c1-25-16-4-3-5-20-15(16)6-11(23)9-22-10-21-14-8-13(19)17(26-2)7-12(14)18(22)24/h7-8,10,15-16,20H,3-6,9H2,1-2H3