N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-2-naphthalen-2-ylsulfanyl-ethanamide

Systemtic Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-2-naphthalen-2-ylsulfanyl-ethanamide Openeye Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-2-(2-naphthylsulfanyl)acetamide CAS Name: N-(1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)-2-(2-naphthalenylthio)acetamide IUPAC Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-2-naphthalen-2-ylsulfanylacetamide Traditional Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-2-(2-naphthylthio)acetamide Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)NC(=O)CSC3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)NC(=O)CSC3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C20H18N4OS/c1-13-18-10-16(11-21-20(18)24(2)23-13)22-19(25)12-26-17-8-7-14-5-3-4-6-15(14)9-17/h3-11H,12H2,1-2H3,(H,22,25)