N-[7-chloranyl-2,4-bis(oxidanylidene)-3-pyridin-3-ylsulfonyl-quinazolin-1-yl]-N-(1-ethylpyridin-1-ium-3-yl)ethanamide iodide

Systemtic Name: N-[7-chloranyl-2,4-bis(oxidanylidene)-3-pyridin-3-ylsulfonyl-quinazolin-1-yl]-N-(1-ethylpyridin-1-ium-3-yl)ethanamide iodide Openeye Name: N-[7-chloro-2,4-dioxo-3-(3-pyridylsulfonyl)quinazolin-1-yl]-N-(1-ethylpyridin-1-ium-3-yl)acetamide iodide CAS Name: N-[7-chloro-2,4-dioxo-3-(3-pyridinylsulfonyl)-1-quinazolinyl]-N-(1-ethyl-3-pyridin-1-iumyl)acetamide iodide IUPAC Name: N-(7-chloro-2,4-dioxo-3-pyridin-3-ylsulfonylquinazolin-1-yl)-N-(1-ethylpyridin-1-ium-3-yl)acetamide iodide Traditional Name: N-[7-chloro-2,4-diketo-3-(3-pyridylsulfonyl)quinazolin-1-yl]-N-(1-ethylpyridin-1-ium-3-yl)acetamide iodide Formula: C22H19ClIN5O5S MolecularWeight: 627.83923

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC(=C1)N(C(=O)C)N2C3=C(C=CC(=C3)Cl)C(=O)N(C2=O)S(=O)(=O)C4=CN=CC=C4.[I-]

Isomeric SMILES

CC[N+]1=CC=CC(=C1)N(C(=O)C)N2C3=C(C=CC(=C3)Cl)C(=O)N(C2=O)S(=O)(=O)C4=CN=CC=C4.[I-]

InChI

InChI=1S/C22H19ClN5O5S.HI/c1-3-25-11-5-6-17(14-25)26(15(2)29)27-20-12-16(23)8-9-19(20)21(30)28(22(27)31)34(32,33)18-7-4-10-24-13-18;/h4-14H,3H2,1-2H3;1H/q+1;/p-1