N-butyl-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-butyl-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-butyl-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-butyl-2-[[2-(4-fluorophenyl)-8-methyl-4-quinazolinyl]thio]acetamide IUPAC Name: N-butyl-2-[2-(4-fluorophenyl)-8-methylquinazolin-4-yl]sulfanylacetamide Traditional Name: N-butyl-2-[[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]thio]acetamide Formula: C21H22FN3OS MolecularWeight: 383.482283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC(=NC2=C1C=CC=C2C)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCNC(=O)CSC1=NC(=NC2=C1C=CC=C2C)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3OS/c1-3-4-12-23-18(26)13-27-21-17-7-5-6-14(2)19(17)24-20(25-21)15-8-10-16(22)11-9-15/h5-11H,3-4,12-13H2,1-2H3,(H,23,26)