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

Systemtic Name: 5-(4-bromophenyl)-6-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-[[2-(4-bromophenyl)-2-oxoethyl]thio]-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 5-(4-bromophenyl)-6-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H12Br2N4O2S MolecularWeight: 520.19718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=C(C=C4)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSC2=NC3=C(C=NN3)C(=O)N2C4=CC=C(C=C4)Br)Br

InChI

InChI=1S/C19H12Br2N4O2S/c20-12-3-1-11(2-4-12)16(26)10-28-19-23-17-15(9-22-24-17)18(27)25(19)14-7-5-13(21)6-8-14/h1-9H,10H2,(H,22,24)