PDB CCD ID: | A1AH9 |
Number of entries in BioLiP: | 6 |
Chemical formula: | C20 H22 N6 |
InChI: | InChI=1S/C20H22N6/c1-2-4-18-16(3-1)17(14-22-18)15-5-6-20-19(13-15)23-24-26(20)12-11-25-9-7-21-8-10-25/h1-6,13-14,21-22H,7-12H2 |
InChIKey: | SYUKRGUWSXQFQM-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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ACDLabs 12.01 | c1c(ccc2c1nnn2CCN1CCNCC1)c1c[NH]c2ccccc21 | CACTVS 3.385 | C1CN(CCN1)CCn2nnc3cc(ccc23)c4c[nH]c5ccccc45 | OpenEye OEToolkits 2.0.7 | c1ccc2c(c1)c(c[nH]2)c3ccc4c(c3)nnn4CCN5CCNCC5 |
|
Name: | (5P)-5-(1H-indol-3-yl)-1-[2-(piperazin-1-yl)ethyl]-1H-1,2,3-benzotriazole |