2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)pyrazol-3-olate

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)pyrazol-3-olate Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)pyrazol-3-olate CAS Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-3-pyrazololate IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)pyrazol-3-olate Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)pyrazol-3-olate Formula: C17H12N3O2S- MolecularWeight: 322.36108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=C2)[O-])C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=C2)[O-])C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N3O2S/c1-22-12-8-6-11(7-9-12)14-10-16(21)20(19-14)17-18-13-4-2-3-5-15(13)23-17/h2-10,21H,1H3/p-1