3-(2-diethylaminoethyl)-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2-diethylaminoethyl)-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2-diethylaminoethyl)-2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(2-diethylaminoethyl)-2-[(3-fluoro-4-methoxyphenyl)methylthio]-4-quinazolinone IUPAC Name: 3-(2-diethylaminoethyl)-2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2-diethylaminoethyl)-2-[(3-fluoro-4-methoxy-benzyl)thio]quinazolin-4-one Formula: C22H26FN3O2S MolecularWeight: 415.524143

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCN(CC)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C22H26FN3O2S/c1-4-25(5-2)12-13-26-21(27)17-8-6-7-9-19(17)24-22(26)29-15-16-10-11-20(28-3)18(23)14-16/h6-11,14H,4-5,12-13,15H2,1-3H3