phenyl 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]ethanoate

Systemtic Name: phenyl 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]ethanoate Openeye Name: phenyl 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]acetate CAS Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]thio]acetic acid phenyl ester IUPAC Name: phenyl 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]acetate Traditional Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]thio]acetic acid phenyl ester Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C(=C(C(=N2)SCC(=O)OC3=CC=CC=C3)C#N)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CN1CCC2=C(C1)C(=C(C(=N2)SCC(=O)OC3=CC=CC=C3)C#N)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C26H25N3O4S/c1-29-12-11-22-21(15-29)25(19-13-18(31-2)9-10-23(19)32-3)20(14-27)26(28-22)34-16-24(30)33-17-7-5-4-6-8-17/h4-10,13H,11-12,15-16H2,1-3H3