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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)CSC2=NC3=C(CN(CC3)C)C(=C2C#N)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)CSC2=NC3=C(CN(CC3)C)C(=C2C#N)C4=CC(=CC=C4)OC

InChI

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