N-[(3-fluorophenyl)methyl]-N-methyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]propanamide IUPAC Name: N-[(3-fluorophenyl)methyl]-N-methyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3-fluorobenzyl)-N-methyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]propionamide Formula: C17H18FN5OS MolecularWeight: 359.421123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC(=CC=C1)F)SC2=NC=NC3=C2C=NN3C

Isomeric SMILES

CC(C(=O)N(C)CC1=CC(=CC=C1)F)SC2=NC=NC3=C2C=NN3C

InChI

InChI=1S/C17H18FN5OS/c1-11(17(24)22(2)9-12-5-4-6-13(18)7-12)25-16-14-8-21-23(3)15(14)19-10-20-16/h4-8,10-11H,9H2,1-3H3