N-[bis(azanyl)methylidene]-5-cyclopropyl-1-[6-(trifluoromethyl)quinolin-8-yl]pyrazole-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-5-cyclopropyl-1-[6-(trifluoromethyl)quinolin-8-yl]pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-N-(diaminomethylene)-1-[6-(trifluoromethyl)-8-quinolyl]pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-N-(diaminomethylidene)-1-[6-(trifluoromethyl)-8-quinolinyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-(diaminomethylidene)-1-[6-(trifluoromethyl)quinolin-8-yl]pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-N-(diaminomethylene)-1-[6-(trifluoromethyl)-8-quinolyl]pyrazole-4-carboxamide Formula: C18H15F3N6O MolecularWeight: 388.34651

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NN2C3=C4C(=CC(=C3)C(F)(F)F)C=CC=N4)C(=O)N=C(N)N

Isomeric SMILES

C1CC1C2=C(C=NN2C3=C4C(=CC(=C3)C(F)(F)F)C=CC=N4)C(=O)N=C(N)N

InChI

InChI=1S/C18H15F3N6O/c19-18(20,21)11-6-10-2-1-5-24-14(10)13(7-11)27-15(9-3-4-9)12(8-25-27)16(28)26-17(22)23/h1-2,5-9H,3-4H2,(H4,22,23,26,28)