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

Systemtic Name: 2-[3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-phenyl-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-phenyl-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-2-phenyl-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-2-phenyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-2-phenyl-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C28H26F3N3O3S MolecularWeight: 541.58455

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCOCCCN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C28H26F3N3O3S/c1-2-37-17-9-16-34-26(36)22-14-6-7-15-23(22)33-27(34)38-24(19-10-4-3-5-11-19)25(35)32-21-13-8-12-20(18-21)28(29,30)31/h3-8,10-15,18,24H,2,9,16-17H2,1H3,(H,32,35)