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

Systemtic Name: 3-cyclopropyl-2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-quinazolin-4-one CAS Name: 3-cyclopropyl-2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanylquinazolin-4-one Traditional Name: 3-cyclopropyl-2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]quinazolin-4-one Formula: C21H19FN2O2S MolecularWeight: 382.451163

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN2O2S/c22-15-9-7-14(8-10-15)19(25)6-3-13-27-21-23-18-5-2-1-4-17(18)20(26)24(21)16-11-12-16/h1-2,4-5,7-10,16H,3,6,11-13H2