2-[2-(2-cyclopropylquinazolin-4-yl)sulfanylethanoylamino]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[2-(2-cyclopropylquinazolin-4-yl)sulfanylethanoylamino]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[[2-(2-cyclopropylquinazolin-4-yl)sulfanylacetyl]amino]-N-(4-fluorophenyl)acetamide CAS Name: 2-[[2-[(2-cyclopropyl-4-quinazolinyl)thio]-1-oxoethyl]amino]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[[2-(2-cyclopropylquinazolin-4-yl)sulfanylacetyl]amino]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[[2-[(2-cyclopropylquinazolin-4-yl)thio]acetyl]amino]-N-(4-fluorophenyl)acetamide Formula: C21H19FN4O2S MolecularWeight: 410.464563

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=N2)SCC(=O)NCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=N2)SCC(=O)NCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H19FN4O2S/c22-14-7-9-15(10-8-14)24-18(27)11-23-19(28)12-29-21-16-3-1-2-4-17(16)25-20(26-21)13-5-6-13/h1-4,7-10,13H,5-6,11-12H2,(H,23,28)(H,24,27)