4-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetyl]amino]benzamide CAS Name: 4-[[1-oxo-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]ethyl]amino]benzamide IUPAC Name: 4-[[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetyl]amino]benzamide Formula: C18H13F3N4O2S MolecularWeight: 406.38163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C18H13F3N4O2S/c19-18(20,21)17-24-13-4-2-1-3-12(13)16(25-17)28-9-14(26)23-11-7-5-10(6-8-11)15(22)27/h1-8H,9H2,(H2,22,27)(H,23,26)