sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxidanylidene-5-(pyridin-4-ylmethyl)pyrazolo[4,3-c]pyridin-6-olate

Systemtic Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxidanylidene-5-(pyridin-4-ylmethyl)pyrazolo[4,3-c]pyridin-6-olate Openeye Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxo-5-(4-pyridylmethyl)pyrazolo[4,3-c]pyridin-6-olate CAS Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxo-5-(pyridin-4-ylmethyl)-6-pyrazolo[4,3-c]pyridinolate IUPAC Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxo-5-(pyridin-4-ylmethyl)pyrazolo[4,3-c]pyridin-6-olate Traditional Name: sodium 2-(1,3-benzothiazol-2-yl)-3-keto-4-methyl-5-(4-pyridylmethyl)pyrazolo[4,3-c]pyridin-6-olate Formula: C20H14N5NaO2S MolecularWeight: 411.41223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1CC5=CC=NC=C5)[O-].[Na+]

Isomeric SMILES

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1CC5=CC=NC=C5)[O-].[Na+]

InChI

InChI=1S/C20H15N5O2S.Na/c1-12-18-15(10-17(26)24(12)11-13-6-8-21-9-7-13)23-25(19(18)27)20-22-14-4-2-3-5-16(14)28-20;/h2-10,26H,11H2,1H3;/q;+1/p-1