7-chloranyl-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-methylbutyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(3-methylbutyl)quinazolin-4-one Openeye Name: 7-chloro-2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-3-isopentyl-quinazolin-4-one CAS Name: 7-chloro-2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-3-(3-methylbutyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-3-(3-methylbutyl)quinazolin-4-one Traditional Name: 7-chloro-2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-3-isoamyl-quinazolin-4-one Formula: C21H20ClFN2O2S MolecularWeight: 418.912103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20ClFN2O2S/c1-13(2)9-10-25-20(27)17-8-5-15(22)11-18(17)24-21(25)28-12-19(26)14-3-6-16(23)7-4-14/h3-8,11,13H,9-10,12H2,1-2H3