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

Systemtic Name: phenyl 2-[[3-cyano-4-(2-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]ethanoate Openeye Name: phenyl 2-[[3-cyano-4-(2-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]acetate CAS Name: 2-[[3-cyano-4-(2-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]thio]acetic acid phenyl ester IUPAC Name: phenyl 2-[[3-cyano-4-(2-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]acetate Traditional Name: 2-[[3-cyano-4-(2-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]thio]acetic acid phenyl ester Formula: C25H23N3O3S MolecularWeight: 445.53342

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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=CC=CC=C4OC

Isomeric SMILES

CN1CCC2=C(C1)C(=C(C(=N2)SCC(=O)OC3=CC=CC=C3)C#N)C4=CC=CC=C4OC

InChI

InChI=1S/C25H23N3O3S/c1-28-13-12-21-20(15-28)24(18-10-6-7-11-22(18)30-2)19(14-26)25(27-21)32-16-23(29)31-17-8-4-3-5-9-17/h3-11H,12-13,15-16H2,1-2H3