7-butylsulfanyl-1-phenyl-2-phenylazanyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one

Systemtic Name: 7-butylsulfanyl-1-phenyl-2-phenylazanyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one Openeye Name: 2-anilino-7-butylsulfanyl-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one CAS Name: 2-anilino-7-(butylthio)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one IUPAC Name: 2-anilino-7-butylsulfanyl-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one Traditional Name: 2-anilino-7-(butylthio)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one Formula: C25H22F3N3OS MolecularWeight: 469.52189

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C(=C1)C(F)(F)F)C(=O)C=C(N2C3=CC=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

CCCCSC1=NC2=C(C(=C1)C(F)(F)F)C(=O)C=C(N2C3=CC=CC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C25H22F3N3OS/c1-2-3-14-33-22-15-19(25(26,27)28)23-20(32)16-21(29-17-10-6-4-7-11-17)31(24(23)30-22)18-12-8-5-9-13-18/h4-13,15-16,29H,2-3,14H2,1H3