30V
Summary
| Name: | S-[(2-carbamoylphenyl)selanyl]-L-cysteine |
| Formula: | C10 H12 N2 O3 S Se |
| Formal charge: | 0 |
| Formula weight: | 319.239 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | S-[(2-carbamoylphenyl)selanyl]-L-cysteine |
| OpenEye OEToolkits | 1.7.6 | (2R)-3-(2-aminocarbonylphenyl)selanylsulfanyl-2-azanyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(N)CS[Se]c1ccccc1C(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C10H12N2O3SSe/c11-7(10(14)15)5-16-17-8-4-2-1-3-6(8)9(12)13/h1-4,7H,5,11H2,(H2,12,13)(H,14,15)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | PCXNBMCCBAIGGP-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](CS[Se]c1ccccc1C(N)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](CS[Se]c1ccccc1C(N)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)C(=O)N)[Se]SC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)C(=O)N)[Se]SCC(C(=O)O)N |
