sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-5-morpholin-4-yl-pyrazolo[4,3-c]pyridin-1-ide-3,6-dione

Systemtic Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-5-morpholin-4-yl-pyrazolo[4,3-c]pyridin-1-ide-3,6-dione Openeye Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-5-morpholino-pyrazolo[4,3-c]pyridin-1-ide-3,6-dione CAS Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(4-morpholinyl)pyrazolo[4,3-c]pyridin-1-ide-3,6-dione IUPAC Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-5-morpholin-4-ylpyrazolo[4,3-c]pyridin-1-ide-3,6-dione Traditional Name: sodium 2-(1,3-benzothiazol-2-yl)-4-methyl-5-morpholino-pyrazolo[4,3-c]pyridin-1-ide-3,6-quinone Formula: C18H16N5NaO3S MolecularWeight: 405.40611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=O)N1N3CCOCC3)[N-]N(C2=O)C4=NC5=CC=CC=C5S4.[Na+]

Isomeric SMILES

CC1=C2C(=CC(=O)N1N3CCOCC3)[N-]N(C2=O)C4=NC5=CC=CC=C5S4.[Na+]

InChI

InChI=1S/C18H17N5O3S.Na/c1-11-16-13(10-15(24)23(11)21-6-8-26-9-7-21)20-22(17(16)25)18-19-12-4-2-3-5-14(12)27-18;/h2-5,10H,6-9H2,1H3,(H,20,24);/q;+1/p-1