2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide

Systemtic Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanamide Openeye Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)acetamide CAS Name: 2-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide IUPAC Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)acetamide Traditional Name: 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)acetamide Formula: C17H14F3N5O2S MolecularWeight: 409.38557

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2CC(=O)NN3C(=O)C4=CC=CC=C4NC3=S)C(F)(F)F

Isomeric SMILES

C1CC1C2=CC(=NN2CC(=O)NN3C(=O)C4=CC=CC=C4NC3=S)C(F)(F)F

InChI

InChI=1S/C17H14F3N5O2S/c18-17(19,20)13-7-12(9-5-6-9)24(22-13)8-14(26)23-25-15(27)10-3-1-2-4-11(10)21-16(25)28/h1-4,7,9H,5-6,8H2,(H,21,28)(H,23,26)