PDB CCD ID: | 1VM |
Number of entries in BioLiP: | 1 |
Chemical formula: | C20 H17 N7 S |
InChI: | InChI=1S/C20H17N7S/c1-10-7-15-16(8-11(10)2)27(18(24-15)19-23-5-6-28-19)12-3-4-13-14(9-12)25-20(22)26-17(13)21/h3-9H,1-2H3,(H4,21,22,25,26) |
InChIKey: | RLRIWYVVMLSWOC-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 1.7.6 | Cc1cc2c(cc1C)n(c(n2)c3nccs3)c4ccc5c(c4)nc(nc5N)N | CACTVS 3.385 | Cc1cc2nc(n(c3ccc4c(N)nc(N)nc4c3)c2cc1C)c5sccn5 | ACDLabs 12.01 | n1ccsc1c2nc5c(n2c4cc3nc(nc(N)c3cc4)N)cc(c(c5)C)C |
|
Name: | 7-[5,6-dimethyl-2-(1,3-thiazol-2-yl)-1H-benzimidazol-1-yl]quinazoline-2,4-diamine |
ChEMBL: | CHEMBL3128021 |
ZINC: | ZINC000068246437 |