N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide Openeye Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-2-[(4-oxo-1H-quinazolin-2-yl)thio]acetamide IUPAC Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)thio]-N-[2-morpholino-5-(trifluoromethyl)phenyl]acetamide Formula: C21H19F3N4O3S MolecularWeight: 464.46077

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H19F3N4O3S/c22-21(23,24)13-5-6-17(28-7-9-31-10-8-28)16(11-13)25-18(29)12-32-20-26-15-4-2-1-3-14(15)19(30)27-20/h1-6,11H,7-10,12H2,(H,25,29)(H,26,27,30)