N-[[7-(2-chloranyl-4-fluoranyl-phenyl)carbonyl-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanyl-benzamide

Systemtic Name: N-[[7-(2-chloranyl-4-fluoranyl-phenyl)carbonyl-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanyl-benzamide Openeye Name: N-[[7-(2-chloro-4-fluoro-benzoyl)-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanyl-benzamide CAS Name: N-[[7-[(2-chloro-4-fluorophenyl)-oxomethyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-(methylthio)benzamide IUPAC Name: N-[[7-(2-chloro-4-fluorobenzoyl)-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-methylsulfanylbenzamide Traditional Name: N-[[7-(2-chloro-4-fluoro-benzoyl)-3-methyl-6,8-dihydro-5H-2,7-naphthyridin-4-yl]methyl]-2-(methylthio)benzamide Formula: C25H23ClFN3O2S MolecularWeight: 483.985423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2CN(CCC2=C1CNC(=O)C3=CC=CC=C3SC)C(=O)C4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CC1=NC=C2CN(CCC2=C1CNC(=O)C3=CC=CC=C3SC)C(=O)C4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C25H23ClFN3O2S/c1-15-21(13-29-24(31)20-5-3-4-6-23(20)33-2)18-9-10-30(14-16(18)12-28-15)25(32)19-8-7-17(27)11-22(19)26/h3-8,11-12H,9-10,13-14H2,1-2H3,(H,29,31)