2-[4-oxidanylidene-2-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide Openeye Name: 2-[4-oxo-2-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]quinazolin-3-yl]acetamide CAS Name: 2-[4-oxo-2-[[[4-(trifluoromethyl)-2-pyrimidinyl]thio]methyl]-3-quinazolinyl]acetamide IUPAC Name: 2-[4-oxo-2-[[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]quinazolin-3-yl]acetamide Traditional Name: 2-[4-keto-2-[[[4-(trifluoromethyl)pyrimidin-2-yl]thio]methyl]quinazolin-3-yl]acetamide Formula: C16H12F3N5O2S MolecularWeight: 395.35899

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CSC3=NC=CC(=N3)C(F)(F)F)CC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CSC3=NC=CC(=N3)C(F)(F)F)CC(=O)N

InChI

InChI=1S/C16H12F3N5O2S/c17-16(18,19)11-5-6-21-15(23-11)27-8-13-22-10-4-2-1-3-9(10)14(26)24(13)7-12(20)25/h1-6H,7-8H2,(H2,20,25)