2-(phenylsulfanylmethyl)-5-propan-2-yloxy-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2,6-naphthyridine-3-carboxylate

Systemtic Name: 2-(phenylsulfanylmethyl)-5-propan-2-yloxy-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2,6-naphthyridine-3-carboxylate Openeye Name: 5-isopropoxy-2-(phenylsulfanylmethyl)-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2,6-naphthyridine-3-carboxylate CAS Name: 2-[(phenylthio)methyl]-5-propan-2-yloxy-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2,6-naphthyridine-3-carboxylate IUPAC Name: 2-(phenylsulfanylmethyl)-5-propan-2-yloxy-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2,6-naphthyridine-3-carboxylate Traditional Name: 5-isopropoxy-2-[(phenylthio)methyl]-4-[2-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2,6-naphthyridine-3-carboxylate Formula: C26H24F3N2O3S- MolecularWeight: 501.54057

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=CC2=C1C(C(N(C2)CSC3=CC=CC=C3)C(=O)[O-])C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC(C)OC1=NC=CC2=C1C(C(N(C2)CSC3=CC=CC=C3)C(=O)[O-])C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C26H25F3N2O3S/c1-16(2)34-24-21-17(12-13-30-24)14-31(15-35-18-8-4-3-5-9-18)23(25(32)33)22(21)19-10-6-7-11-20(19)26(27,28)29/h3-13,16,22-23H,14-15H2,1-2H3,(H,32,33)/p-1