2-[4-oxidanylidene-2-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]quinazolin-3-yl]ethanamide Openeye Name: 2-[4-oxo-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]quinazolin-3-yl]acetamide CAS Name: 2-[4-oxo-2-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-3-quinazolinyl]acetamide IUPAC Name: 2-[4-oxo-2-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]quinazolin-3-yl]acetamide Traditional Name: 2-[4-keto-2-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]quinazolin-3-yl]acetamide Formula: C17H13F3N4O2S MolecularWeight: 394.37093

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CSC3=NC=C(C=C3)C(F)(F)F)CC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CSC3=NC=C(C=C3)C(F)(F)F)CC(=O)N

InChI

InChI=1S/C17H13F3N4O2S/c18-17(19,20)10-5-6-15(22-7-10)27-9-14-23-12-4-2-1-3-11(12)16(26)24(14)8-13(21)25/h1-7H,8-9H2,(H2,21,25)