| PDB CCD ID: | TYX |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C11 H14 N2 O3 S |
| InChI: | InChI=1S/C11H14N2O3S/c12-9(11(15)16)6-17-7-10(14)13-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,14)(H,15,16)/t9-/m0/s1 |
| InChIKey: | KIOKPANRTZJOEP-VIFPVBQESA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | c1ccc(cc1)NC(=O)CSC[C@@H](C(=O)O)N | | CACTVS 3.341 | N[CH](CSCC(=O)Nc1ccccc1)C(O)=O | | CACTVS 3.341 | N[C@@H](CSCC(=O)Nc1ccccc1)C(O)=O | | ACDLabs 10.04 | O=C(Nc1ccccc1)CSCC(C(=O)O)N | | OpenEye OEToolkits 1.5.0 | c1ccc(cc1)NC(=O)CSCC(C(=O)O)N |
|
| Name: | S-(2-ANILINO-2-OXOETHYL)-L-CYSTEINE |
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