1-[4-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-1-oxoethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetyl]phenyl]-2-pyrrolidone Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C18H17N5O2S/c1-22-17-14(9-21-22)18(20-11-19-17)26-10-15(24)12-4-6-13(7-5-12)23-8-2-3-16(23)25/h4-7,9,11H,2-3,8,10H2,1H3