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

Systemtic Name: tert-butyl 2-[(3-cyano-6-methyl-2-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridin-4-yl)sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[3-cyano-6-methyl-2-(2-thienyl)-7,8-dihydro-5H-1,6-naphthyridin-4-yl]sulfanyl]acetate CAS Name: 2-[(3-cyano-6-methyl-2-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridin-4-yl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3-cyano-6-methyl-2-thiophen-2-yl-7,8-dihydro-5H-1,6-naphthyridin-4-yl)sulfanyl]acetate Traditional Name: 2-[[3-cyano-6-methyl-2-(2-thienyl)-7,8-dihydro-5H-1,6-naphthyridin-4-yl]thio]acetic acid tert-butyl ester Formula: C20H23N3O2S2 MolecularWeight: 401.54552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=C(C(=NC2=C1CN(CC2)C)C3=CC=CS3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=C(C(=NC2=C1CN(CC2)C)C3=CC=CS3)C#N

InChI

InChI=1S/C20H23N3O2S2/c1-20(2,3)25-17(24)12-27-19-13(10-21)18(16-6-5-9-26-16)22-15-7-8-23(4)11-14(15)19/h5-6,9H,7-8,11-12H2,1-4H3