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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(3-morpholin-4-ylpropyl)-3-oxidanylidene-pyrazolo[4,3-c]pyridin-6-olate Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(3-morpholinopropyl)-3-oxo-pyrazolo[4,3-c]pyridin-6-olate CAS Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-[3-(4-morpholinyl)propyl]-3-oxo-6-pyrazolo[4,3-c]pyridinolate IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(3-morpholin-4-ylpropyl)-3-oxopyrazolo[4,3-c]pyridin-6-olate Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-keto-4-methyl-5-(3-morpholinopropyl)pyrazolo[4,3-c]pyridin-6-olate Formula: C21H22N5O3S- MolecularWeight: 424.49608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1CCCN5CCOCC5)[O-]

Isomeric SMILES

CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1CCCN5CCOCC5)[O-]

InChI

InChI=1S/C21H23N5O3S/c1-14-19-16(13-18(27)25(14)8-4-7-24-9-11-29-12-10-24)23-26(20(19)28)21-22-15-5-2-3-6-17(15)30-21/h2-3,5-6,13,27H,4,7-12H2,1H3/p-1