4-[3-(3-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-pentyl-butanamide

Systemtic Name: 4-[3-(3-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-pentyl-butanamide Openeye Name: 4-[3-(3-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-pentyl-butanamide CAS Name: 4-[[3-(3-fluorophenyl)-4-oxo-2-quinazolinyl]thio]-N-pentylbutanamide IUPAC Name: 4-[3-(3-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-pentylbutanamide Traditional Name: N-amyl-4-[[3-(3-fluorophenyl)-4-keto-quinazolin-2-yl]thio]butyramide Formula: C23H26FN3O2S MolecularWeight: 427.534843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)F

Isomeric SMILES

CCCCCNC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC(=CC=C3)F

InChI

InChI=1S/C23H26FN3O2S/c1-2-3-6-14-25-21(28)13-8-15-30-23-26-20-12-5-4-11-19(20)22(29)27(23)18-10-7-9-17(24)16-18/h4-5,7,9-12,16H,2-3,6,8,13-15H2,1H3,(H,25,28)