2-methyl-1-[4-[6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[6-methyl-1-(2-thienylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[[6-methyl-1-(thiophen-2-ylmethyl)-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-[6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[6-methyl-1-(2-thenyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazino]propan-1-one Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)N4CCN(CC4)C(=O)C(C)C

Isomeric SMILES

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)N4CCN(CC4)C(=O)C(C)C

InChI

InChI=1S/C21H25N5O2S/c1-14(2)20(27)24-6-8-25(9-7-24)21(28)17-11-15(3)23-19-18(17)12-22-26(19)13-16-5-4-10-29-16/h4-5,10-12,14H,6-9,13H2,1-3H3