RPW
Summary
Name: | 2-[2-[(6-methylpyridin-2-yl)amino]-1,3-thiazol-4-yl]-~{N}-(5-methyl-1,3-thiazol-2-yl)ethanamide |
Formula: | C15 H15 N5 O S2 |
Formal charge: | 0 |
Formula weight: | 345.443 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 3.1.0.0 | 2-[2-[(6-methylpyridin-2-yl)amino]-1,3-thiazol-4-yl]-~{N}-(5-methyl-1,3-thiazol-2-yl)ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C15H15N5OS2/c1-9-4-3-5-12(17-9)19-15-18-11(8-22-15)6-13(21)20-14-16-7-10(2)23-14/h3-5,7-8H,6H2,1-2H3,(H,16,20,21)(H,17,18,19) |
InChIKey | InChI | 1.06 | QMRBCNQCRMTXBE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1sc(NC(=O)Cc2csc(Nc3cccc(C)n3)n2)nc1 |
SMILES | CACTVS | 3.385 | Cc1sc(NC(=O)Cc2csc(Nc3cccc(C)n3)n2)nc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1cccc(n1)Nc2nc(cs2)CC(=O)Nc3ncc(s3)C |
SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1cccc(n1)Nc2nc(cs2)CC(=O)Nc3ncc(s3)C |