3-(4,6-dimethyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-5-yl)-N-(2-prop-2-enylsulfanylphenyl)propanamide

Systemtic Name: 3-(4,6-dimethyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-5-yl)-N-(2-prop-2-enylsulfanylphenyl)propanamide Openeye Name: N-(2-allylsulfanylphenyl)-3-(1-isopropyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-5-yl)propanamide CAS Name: 3-(4,6-dimethyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)-N-[2-(prop-2-enylthio)phenyl]propanamide IUPAC Name: 3-(4,6-dimethyl-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-N-(2-prop-2-enylsulfanylphenyl)propanamide Traditional Name: N-[2-(allylthio)phenyl]-3-(1-isopropyl-4,6-dimethyl-pyrazolo[3,4-b]pyridin-5-yl)propionamide Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=NN(C2=NC(=C1CCC(=O)NC3=CC=CC=C3SCC=C)C)C(C)C

Isomeric SMILES

CC1=C2C=NN(C2=NC(=C1CCC(=O)NC3=CC=CC=C3SCC=C)C)C(C)C

InChI

InChI=1S/C23H28N4OS/c1-6-13-29-21-10-8-7-9-20(21)26-22(28)12-11-18-16(4)19-14-24-27(15(2)3)23(19)25-17(18)5/h6-10,14-15H,1,11-13H2,2-5H3,(H,26,28)