3-(3-morpholin-4-ylpropyl)-2-sulfanylidene-7-(trifluoromethyl)quinazolin-4-olate

Systemtic Name: 3-(3-morpholin-4-ylpropyl)-2-sulfanylidene-7-(trifluoromethyl)quinazolin-4-olate Openeye Name: 3-(3-morpholinopropyl)-2-thioxo-7-(trifluoromethyl)quinazolin-4-olate CAS Name: 3-[3-(4-morpholinyl)propyl]-2-sulfanylidene-7-(trifluoromethyl)-4-quinazolinolate IUPAC Name: 3-(3-morpholin-4-ylpropyl)-2-sulfanylidene-7-(trifluoromethyl)quinazolin-4-olate Traditional Name: 3-(3-morpholinopropyl)-2-thioxo-7-(trifluoromethyl)quinazolin-4-olate Formula: C16H17F3N3O2S- MolecularWeight: 372.38529

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN2C(=C3C=CC(=CC3=NC2=S)C(F)(F)F)[O-]

Isomeric SMILES

C1COCCN1CCCN2C(=C3C=CC(=CC3=NC2=S)C(F)(F)F)[O-]

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/h2-3,10,23H,1,4-9H2/p-1