SY0
Summary
Name: | (2~{S})-2-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazol-1-yl]ethanoylamino]-~{N}-ethyl-propanamide |
Formula: | C15 H21 N5 O3 |
Formal charge: | 0 |
Formula weight: | 319.359 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (2~{S})-2-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)pyrazol-1-yl]ethanoylamino]-~{N}-ethyl-propanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C15H21N5O3/c1-5-16-15(22)10(3)18-13(21)8-20-7-12(6-17-20)14-9(2)19-23-11(14)4/h6-7,10H,5,8H2,1-4H3,(H,16,22)(H,18,21)/t10-/m0/s1 |
InChIKey | InChI | 1.06 | UJPHDNXNLWIDIQ-JTQLQIEISA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCNC(=O)[C@H](C)NC(=O)Cn1cc(cn1)c2c(C)onc2C |
SMILES | CACTVS | 3.385 | CCNC(=O)[CH](C)NC(=O)Cn1cc(cn1)c2c(C)onc2C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCNC(=O)[C@H](C)NC(=O)Cn1cc(cn1)c2c(noc2C)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CCNC(=O)C(C)NC(=O)Cn1cc(cn1)c2c(noc2C)C |