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

Systemtic Name: sodium 2-(1,3-benzothiazol-2-yl)-5-cyclopropyl-4-methyl-3-oxidanylidene-pyrazolo[4,3-c]pyridin-6-olate Openeye Name: sodium 2-(1,3-benzothiazol-2-yl)-5-cyclopropyl-4-methyl-3-oxo-pyrazolo[4,3-c]pyridin-6-olate CAS Name: sodium 2-(1,3-benzothiazol-2-yl)-5-cyclopropyl-4-methyl-3-oxo-6-pyrazolo[4,3-c]pyridinolate IUPAC Name: sodium 2-(1,3-benzothiazol-2-yl)-5-cyclopropyl-4-methyl-3-oxopyrazolo[4,3-c]pyridin-6-olate Traditional Name: sodium 2-(1,3-benzothiazol-2-yl)-5-cyclopropyl-3-keto-4-methyl-pyrazolo[4,3-c]pyridin-6-olate Formula: C17H13N4NaO2S MolecularWeight: 360.36549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1C5CC5)[O-].[Na+]

Isomeric SMILES

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1C5CC5)[O-].[Na+]

InChI

InChI=1S/C17H14N4O2S.Na/c1-9-15-12(8-14(22)20(9)10-6-7-10)19-21(16(15)23)17-18-11-4-2-3-5-13(11)24-17;/h2-5,8,10,22H,6-7H2,1H3;/q;+1/p-1