N-(2,3-dimethylphenyl)-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[2-(4-fluorophenyl)-8-methyl-4-quinazolinyl]thio]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[2-(4-fluorophenyl)-8-methylquinazolin-4-yl]sulfanylacetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[[2-(4-fluorophenyl)-8-methyl-quinazolin-4-yl]thio]acetamide Formula: C25H22FN3OS MolecularWeight: 431.525083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CSC2=NC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CSC2=NC(=NC3=C2C=CC=C3C)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C25H22FN3OS/c1-15-6-5-9-21(17(15)3)27-22(30)14-31-25-20-8-4-7-16(2)23(20)28-24(29-25)18-10-12-19(26)13-11-18/h4-13H,14H2,1-3H3,(H,27,30)