2-(1,3-benzothiazol-2-yl)-4-methyl-5-(4-methylpiperazin-4-ium-1-yl)-1H-pyrazolo[4,3-c]pyridine-3,6-dione

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(4-methylpiperazin-4-ium-1-yl)-1H-pyrazolo[4,3-c]pyridine-3,6-dione Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(4-methylpiperazin-4-ium-1-yl)-1H-pyrazolo[4,3-c]pyridine-3,6-dione CAS Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(4-methyl-1-piperazin-4-iumyl)-1H-pyrazolo[4,3-c]pyridine-3,6-dione IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(4-methylpiperazin-4-ium-1-yl)-1H-pyrazolo[4,3-c]pyridine-3,6-dione Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-methyl-5-(4-methylpiperazin-4-ium-1-yl)-1H-pyrazolo[4,3-c]pyridine-3,6-quinone Formula: C19H21N6O2S+ MolecularWeight: 397.47404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=O)N1N3CC[NH+](CC3)C)NN(C2=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C2C(=CC(=O)N1N3CC[NH+](CC3)C)NN(C2=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C19H20N6O2S/c1-12-17-14(11-16(26)25(12)23-9-7-22(2)8-10-23)21-24(18(17)27)19-20-13-5-3-4-6-15(13)28-19/h3-6,11,21H,7-10H2,1-2H3/p+1