3-methoxy-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: 3-methoxy-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide Openeye Name: 3-methoxy-N-[[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide CAS Name: 3-methoxy-N-[[2-(1-piperidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: 3-methoxy-N-[[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide Traditional Name: 3-methoxy-N-[[2-piperidino-5-(trifluoromethyl)phenyl]thiocarbamoyl]-2-naphthamide Formula: C25H24F3N3O2S MolecularWeight: 487.53717

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=C(C=CC(=C3)C(F)(F)F)N4CCCCC4

InChI

InChI=1S/C25H24F3N3O2S/c1-33-22-14-17-8-4-3-7-16(17)13-19(22)23(32)30-24(34)29-20-15-18(25(26,27)28)9-10-21(20)31-11-5-2-6-12-31/h3-4,7-10,13-15H,2,5-6,11-12H2,1H3,(H2,29,30,32,34)