5-(4-bromophenyl)-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 5-(4-bromophenyl)-6-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-[(2-keto-2-pyrrolidino-ethyl)thio]-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H16BrN5O2S MolecularWeight: 434.31024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=C(C=C4)Br

InChI

InChI=1S/C17H16BrN5O2S/c18-11-3-5-12(6-4-11)23-16(25)13-9-19-21-15(13)20-17(23)26-10-14(24)22-7-1-2-8-22/h3-6,9H,1-2,7-8,10H2,(H,19,21)