2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one

Systemtic Name: 2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Openeye Name: 2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one CAS Name: 2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-3-(2-methoxyethyl)-4-quinazolinone IUPAC Name: 2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-3-(2-methoxyethyl)quinazolin-4-one Traditional Name: 2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C21H21FN2O3S MolecularWeight: 400.466443

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=CC=CC=C2N=C1SCCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COCCN1C(=O)C2=CC=CC=C2N=C1SCCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O3S/c1-27-13-12-24-20(26)17-5-2-3-6-18(17)23-21(24)28-14-4-7-19(25)15-8-10-16(22)11-9-15/h2-3,5-6,8-11H,4,7,12-14H2,1H3