N-[(6-pentoxypyridin-3-yl)carbamothioyl]-2-(trifluoromethyl)-1,6-naphthyridine-3-carboxamide

Systemtic Name: N-[(6-pentoxypyridin-3-yl)carbamothioyl]-2-(trifluoromethyl)-1,6-naphthyridine-3-carboxamide Openeye Name: N-[(6-pentoxy-3-pyridyl)carbamothioyl]-2-(trifluoromethyl)-1,6-naphthyridine-3-carboxamide CAS Name: N-[[(6-pentoxy-3-pyridinyl)amino]-sulfanylidenemethyl]-2-(trifluoromethyl)-1,6-naphthyridine-3-carboxamide IUPAC Name: N-[(6-pentoxypyridin-3-yl)carbamothioyl]-2-(trifluoromethyl)-1,6-naphthyridine-3-carboxamide Traditional Name: N-[(6-amoxy-3-pyridyl)thiocarbamoyl]-2-(trifluoromethyl)-1,6-naphthyridine-3-carboxamide Formula: C21H20F3N5O2S MolecularWeight: 463.47601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=NC=C(C=C1)NC(=S)NC(=O)C2=C(N=C3C=CN=CC3=C2)C(F)(F)F

Isomeric SMILES

CCCCCOC1=NC=C(C=C1)NC(=S)NC(=O)C2=C(N=C3C=CN=CC3=C2)C(F)(F)F

InChI

InChI=1S/C21H20F3N5O2S/c1-2-3-4-9-31-17-6-5-14(12-26-17)27-20(32)29-19(30)15-10-13-11-25-8-7-16(13)28-18(15)21(22,23)24/h5-8,10-12H,2-4,9H2,1H3,(H2,27,29,30,32)