3-(3-morpholin-4-ylpropyl)-2-sulfanylidene-7-(trifluoromethyl)-1H-quinazolin-4-one

Systemtic Name: 3-(3-morpholin-4-ylpropyl)-2-sulfanylidene-7-(trifluoromethyl)-1H-quinazolin-4-one Openeye Name: 3-(3-morpholinopropyl)-2-thioxo-7-(trifluoromethyl)-1H-quinazolin-4-one CAS Name: 3-[3-(4-morpholinyl)propyl]-2-sulfanylidene-7-(trifluoromethyl)-1H-quinazolin-4-one IUPAC Name: 3-(3-morpholin-4-ylpropyl)-2-sulfanylidene-7-(trifluoromethyl)-1H-quinazolin-4-one Traditional Name: 3-(3-morpholinopropyl)-2-thioxo-7-(trifluoromethyl)-1H-quinazolin-4-one Formula: C16H18F3N3O2S MolecularWeight: 373.39323

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN2C(=O)C3=C(C=C(C=C3)C(F)(F)F)NC2=S

Isomeric SMILES

C1COCCN1CCCN2C(=O)C3=C(C=C(C=C3)C(F)(F)F)NC2=S

InChI

InChI=1S/C16H18F3N3O2S/c17-16(18,19)11-2-3-12-13(10-11)20-15(25)22(14(12)23)5-1-4-21-6-8-24-9-7-21/h2-3,10H,1,4-9H2,(H,20,25)