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

Systemtic Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxidanylidene-5-(thiophen-2-ylmethyl)pyrazolo[4,3-c]pyridin-6-olate Openeye Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxo-5-(2-thienylmethyl)pyrazolo[4,3-c]pyridin-6-olate CAS Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxo-5-(thiophen-2-ylmethyl)-6-pyrazolo[4,3-c]pyridinolate IUPAC Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-3-oxo-5-(thiophen-2-ylmethyl)pyrazolo[4,3-c]pyridin-6-olate Traditional Name: sodium 2-(1,3-benzothiazol-2-yl)-3-keto-4-methyl-5-(2-thenyl)pyrazolo[4,3-c]pyridin-6-olate Formula: C19H13N4NaO2S2 MolecularWeight: 416.45189

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1CC5=CC=CS5)[O-].[Na+]

Isomeric SMILES

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1CC5=CC=CS5)[O-].[Na+]

InChI

InChI=1S/C19H14N4O2S2.Na/c1-11-17-14(9-16(24)22(11)10-12-5-4-8-26-12)21-23(18(17)25)19-20-13-6-2-3-7-15(13)27-19;/h2-9,24H,10H2,1H3;/q;+1/p-1