diethyl-[2-[2-[2-(3-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethyl]azanium

Systemtic Name: diethyl-[2-[2-[2-(3-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethyl]azanium Openeye Name: diethyl-[2-[2-[2-(3-fluorophenyl)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]ethyl]ammonium CAS Name: diethyl-[2-[2-[[2-(3-fluorophenyl)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]ethyl]ammonium IUPAC Name: diethyl-[2-[2-[2-(3-fluorophenyl)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]ethyl]azanium Traditional Name: diethyl-[2-[2-[[2-(3-fluorophenyl)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]ethyl]ammonium Formula: C22H25FN3O2S+ MolecularWeight: 414.516203

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CC[NH+](CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H24FN3O2S/c1-3-25(4-2)12-13-26-21(28)18-10-5-6-11-19(18)24-22(26)29-15-20(27)16-8-7-9-17(23)14-16/h5-11,14H,3-4,12-13,15H2,1-2H3/p+1