(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: (1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: (1-isopropylpyrazolo[3,4-b]pyridin-5-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: (1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: (1-isopropylpyrazolo[3,4-b]pyridin-5-yl)-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C19H23N6O+ MolecularWeight: 351.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C19H22N6O/c1-14(2)25-18-15(13-22-25)11-16(12-21-18)19(26)24-9-7-23(8-10-24)17-5-3-4-6-20-17/h3-6,11-14H,7-10H2,1-2H3/p+1