5XQ
Summary
| Name: | ~{N}-[5-[2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]ethanamide |
| Formula: | C16 H16 N4 O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 360.454 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | ~{N}-[5-[2-[(2-methoxyphenyl)amino]-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H16N4O2S2/c1-9-14(24-16(17-9)18-10(2)21)12-8-23-15(20-12)19-11-6-4-5-7-13(11)22-3/h4-8H,1-3H3,(H,19,20)(H,17,18,21) |
| InChIKey | InChI | 1.03 | ZADCDCMLLGDCRM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccccc1Nc2scc(n2)c3sc(NC(C)=O)nc3C |
| SMILES | CACTVS | 3.385 | COc1ccccc1Nc2scc(n2)c3sc(NC(C)=O)nc3C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | Cc1c(sc(n1)NC(=O)C)c2csc(n2)Nc3ccccc3OC |
| SMILES | OpenEye OEToolkits | 2.0.4 | Cc1c(sc(n1)NC(=O)C)c2csc(n2)Nc3ccccc3OC |
