PDB CCD ID: | 63M |
Number of entries in BioLiP: | 1 |
Chemical formula: | C15 H19 N7 O3 S |
InChI: | InChI=1S/C15H19N7O3S/c1-15(2,3)19-14(23)10-9-17-22-8-6-11(18-13(10)22)20-26(24,25)12-5-7-16-21(12)4/h5-9H,1-4H3,(H,18,20)(H,19,23) |
InChIKey: | TXLKGLIVYSFVAR-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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ACDLabs 12.01 | CC(C)(C)NC(=O)c1cnn2c1nc(cc2)NS(=O)(c3ccnn3C)=O | OpenEye OEToolkits 2.0.4 | CC(C)(C)NC(=O)c1cnn2c1nc(cc2)NS(=O)(=O)c3ccnn3C | CACTVS 3.385 | Cn1nccc1[S](=O)(=O)Nc2ccn3ncc(C(=O)NC(C)(C)C)c3n2 |
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Name: | N-tert-butyl-5-{[(1-methyl-1H-pyrazol-5-yl)sulfonyl]amino}pyrazolo[1,5-a]pyrimidine-3-carboxamide |
ZINC: | ZINC000113756470 |