6-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 6-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyridine-3-carboxamide Openeye Name: 6-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyridine-3-carboxamide CAS Name: 6-methyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 6-methyl-N-[3-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)phenyl]pyridine-3-carboxamide Traditional Name: 6-methyl-N-[3-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]phenyl]nicotinamide Formula: C19H16N6OS MolecularWeight: 376.43494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NC2=CC=CC(=C2)CSC3=NC=NC4=C3C=NN4

InChI

InChI=1S/C19H16N6OS/c1-12-5-6-14(8-20-12)18(26)24-15-4-2-3-13(7-15)10-27-19-16-9-23-25-17(16)21-11-22-19/h2-9,11H,10H2,1H3,(H,24,26)(H,21,22,23,25)