N-(3-chloranyl-4-methyl-phenyl)-2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[6-ethyl-2-(4-fluorophenyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]thio]acetamide Formula: C25H21ClFN3OS MolecularWeight: 465.970143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=CC(=C(C=C3)C)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=CC(=C(C=C3)C)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21ClFN3OS/c1-3-16-5-11-22-20(12-16)25(30-24(29-22)17-6-8-18(27)9-7-17)32-14-23(31)28-19-10-4-15(2)21(26)13-19/h4-13H,3,14H2,1-2H3,(H,28,31)