2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-fluorophenyl)acetamide CAS Name: 2-[[3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-fluorophenyl)acetamide Traditional Name: 2-[[3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(3-fluorophenyl)acetamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C21H22FN3O3S/c1-2-28-12-6-11-25-20(27)17-9-3-4-10-18(17)24-21(25)29-14-19(26)23-16-8-5-7-15(22)13-16/h3-5,7-10,13H,2,6,11-12,14H2,1H3,(H,23,26)