4-(3,4-dimethoxyphenyl)-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile

Systemtic Name: 4-(3,4-dimethoxyphenyl)-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Openeye Name: 4-(3,4-dimethoxyphenyl)-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile CAS Name: 4-(3,4-dimethoxyphenyl)-2-[(4-fluorophenyl)methylthio]-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile IUPAC Name: 4-(3,4-dimethoxyphenyl)-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[(4-fluorobenzyl)thio]-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Formula: C25H24FN3O2S MolecularWeight: 449.540363

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C(=C(C(=N2)SCC3=CC=C(C=C3)F)C#N)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1CCC2=C(C1)C(=C(C(=N2)SCC3=CC=C(C=C3)F)C#N)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H24FN3O2S/c1-29-11-10-21-20(14-29)24(17-6-9-22(30-2)23(12-17)31-3)19(13-27)25(28-21)32-15-16-4-7-18(26)8-5-16/h4-9,12H,10-11,14-15H2,1-3H3