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

Systemtic Name: 4-(3,4-dimethoxyphenyl)-6-methyl-2-(phenylmethylsulfanyl)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Openeye Name: 2-benzylsulfanyl-4-(3,4-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile CAS Name: 4-(3,4-dimethoxyphenyl)-6-methyl-2-(phenylmethylthio)-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile IUPAC Name: 2-benzylsulfanyl-4-(3,4-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridine-3-carbonitrile Traditional Name: 2-(benzylthio)-4-(3,4-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=CC(=C(C=C4)OC)OC

Isomeric SMILES

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

InChI

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