1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidine-4-thiolate

Systemtic Name: 1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidine-4-thiolate Openeye Name: 1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidine-4-thiolate CAS Name: 1-(4-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinethiolate IUPAC Name: 1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidine-4-thiolate Traditional Name: 1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidine-4-thiolate Formula: C11H6ClN4S- MolecularWeight: 261.71014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C3=C(C=N2)C(=NC=N3)[S-])Cl

Isomeric SMILES

C1=CC(=CC=C1N2C3=C(C=N2)C(=NC=N3)[S-])Cl

InChI

InChI=1S/C11H7ClN4S/c12-7-1-3-8(4-2-7)16-10-9(5-15-16)11(17)14-6-13-10/h1-6H,(H,13,14,17)/p-1