G6Z
Summary
Name: | 1-azanyl-~{N}-[5-(5-azanylpyridin-3-yl)-4-ethanoyl-1,3-thiazol-2-yl]cyclobutane-1-carboxamide |
Formula: | C15 H17 N5 O2 S |
Formal charge: | 0 |
Formula weight: | 331.393 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 1-azanyl-~{N}-[5-(5-azanylpyridin-3-yl)-4-ethanoyl-1,3-thiazol-2-yl]cyclobutane-1-carboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C15H17N5O2S/c1-8(21)11-12(9-5-10(16)7-18-6-9)23-14(19-11)20-13(22)15(17)3-2-4-15/h5-7H,2-4,16-17H2,1H3,(H,19,20,22) |
InChIKey | InChI | 1.03 | KPPWHTAJUPKUOO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)c1nc(NC(=O)C2(N)CCC2)sc1c3cncc(N)c3 |
SMILES | CACTVS | 3.385 | CC(=O)c1nc(NC(=O)C2(N)CCC2)sc1c3cncc(N)c3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)c1c(sc(n1)NC(=O)C2(CCC2)N)c3cc(cnc3)N |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)c1c(sc(n1)NC(=O)C2(CCC2)N)c3cc(cnc3)N |