1-methyl-4-[4-(1,3,6-trimethylpyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-(1,3,6-trimethylpyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-(1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[oxo-(1,3,6-trimethyl-4-pyrazolo[3,4-b]pyridinyl)methyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-(1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-(1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C20H25N7O4S MolecularWeight: 459.522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

Isomeric SMILES

CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

InChI

InChI=1S/C20H25N7O4S/c1-12-9-15(17-13(2)23-25(4)19(17)22-12)20(29)26-5-7-27(8-6-26)32(30,31)14-10-16(18(21)28)24(3)11-14/h9-11H,5-8H2,1-4H3,(H2,21,28)