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

Systemtic Name: (2-methylphenyl) 2-[[3-cyano-4-(3-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]ethanoate Openeye Name: o-tolyl 2-[[3-cyano-4-(3-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]acetate CAS Name: 2-[[3-cyano-4-(3-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]thio]acetic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 2-[[3-cyano-4-(3-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]sulfanyl]acetate Traditional Name: 2-[[3-cyano-4-(3-methoxyphenyl)-6-methyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl]thio]acetic acid o-tolyl ester Formula: C26H25N3O3S MolecularWeight: 459.56

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)CSC2=NC3=C(CN(CC3)C)C(=C2C#N)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC=CC=C1OC(=O)CSC2=NC3=C(CN(CC3)C)C(=C2C#N)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H25N3O3S/c1-17-7-4-5-10-23(17)32-24(30)16-33-26-20(14-27)25(18-8-6-9-19(13-18)31-3)21-15-29(2)12-11-22(21)28-26/h4-10,13H,11-12,15-16H2,1-3H3