4-(2,3-dimethoxyphenyl)-6-methyl-2-(phenylmethylsulfanyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile

Systemtic Name: 4-(2,3-dimethoxyphenyl)-6-methyl-2-(phenylmethylsulfanyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Openeye Name: 2-benzylsulfanyl-4-(2,3-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile CAS Name: 4-(2,3-dimethoxyphenyl)-6-methyl-2-(phenylmethylthio)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile IUPAC Name: 2-benzylsulfanyl-4-(2,3-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Traditional Name: 2-(benzylthio)-4-(2,3-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O2S/c1-28-13-12-21-20(15-28)23(18-10-7-11-22(29-2)24(18)30-3)19(14-26)25(27-21)31-16-17-8-5-4-6-9-17/h4-11H,12-13,15-16H2,1-3H3