3-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-1-methyl-6-(2-phenylsulfanylethanoyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one

Systemtic Name: 3-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-1-methyl-6-(2-phenylsulfanylethanoyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Openeye Name: 3-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-1-methyl-6-(2-phenylsulfanylacetyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one CAS Name: 3-[3-(3,5-dimethyl-1-pyrazolyl)phenyl]-1-methyl-6-[1-oxo-2-(phenylthio)ethyl]-7,8-dihydro-5H-1,6-naphthyridin-2-one IUPAC Name: 3-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-1-methyl-6-(2-phenylsulfanylacetyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Traditional Name: 3-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-1-methyl-6-[2-(phenylthio)acetyl]-7,8-dihydro-5H-1,6-naphthyridin-2-one Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=CC(=C2)C3=CC4=C(CCN(C4)C(=O)CSC5=CC=CC=C5)N(C3=O)C)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=CC(=C2)C3=CC4=C(CCN(C4)C(=O)CSC5=CC=CC=C5)N(C3=O)C)C

InChI

InChI=1S/C28H28N4O2S/c1-19-14-20(2)32(29-19)23-9-7-8-21(15-23)25-16-22-17-31(13-12-26(22)30(3)28(25)34)27(33)18-35-24-10-5-4-6-11-24/h4-11,14-16H,12-13,17-18H2,1-3H3