5-(1,3-benzothiazol-2-yl)-2-propan-2-yl-pyrazolo[1,5-a]pyrimidin-7-olate

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-2-propan-2-yl-pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 5-(1,3-benzothiazol-2-yl)-2-isopropyl-pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 5-(1,3-benzothiazol-2-yl)-2-propan-2-yl-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 5-(1,3-benzothiazol-2-yl)-2-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 5-(1,3-benzothiazol-2-yl)-2-isopropyl-pyrazolo[1,5-a]pyrimidin-7-olate Formula: C16H13N4OS- MolecularWeight: 309.36562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN2C(=C1)N=C(C=C2[O-])C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)C1=NN2C(=C1)N=C(C=C2[O-])C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H14N4OS/c1-9(2)11-7-14-17-12(8-15(21)20(14)19-11)16-18-10-5-3-4-6-13(10)22-16/h3-9,21H,1-2H3/p-1