MV5
Summary
| Name: | (2~{R})-2-azanyl-3-[[(2~{R})-2-azanyl-3-oxidanylidene-propyl]disulfanyl]propanamide |
| Formula: | C6 H13 N3 O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 223.316 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-2-azanyl-3-[[(2~{R})-2-azanyl-3-oxidanylidene-propyl]disulfanyl]propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H13N3O2S2/c7-4(1-10)2-12-13-3-5(8)6(9)11/h1,4-5H,2-3,7-8H2,(H2,9,11)/t4-,5+/m1/s1 |
| InChIKey | InChI | 1.03 | YPDYDODADSFOTL-UHNVWZDZSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CSSC[C@H](N)C(N)=O)C=O |
| SMILES | CACTVS | 3.385 | N[CH](CSSC[CH](N)C(N)=O)C=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C([C@@H](C=O)N)SSC[C@@H](C(=O)N)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | C(C(C=O)N)SSCC(C(=O)N)N |
