| PDB CCD ID: | HHC |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C13 H15 N5 O4 S |
| InChI: | InChI=1S/C13H15N5O4S/c14-7(10(15)19)4-17-11(20)6-1-2-16-8(3-6)12-18-9(5-23-12)13(21)22/h1-3,7,9H,4-5,14H2,(H2,15,19)(H,17,20)(H,21,22)/t7-,9+/m1/s1 |
| InChIKey: | OCKXDMGUYKOZJM-APPZFPTMSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | c1cnc(cc1C(=O)NCC(C(=O)N)N)C2=NC(CS2)C(=O)O | | OpenEye OEToolkits 2.0.7 | c1cnc(cc1C(=O)NC[C@H](C(=O)N)N)C2=N[C@@H](CS2)C(=O)O | | CACTVS 3.385 | N[C@H](CNC(=O)c1ccnc(c1)C2=N[C@@H](CS2)C(O)=O)C(N)=O | | CACTVS 3.385 | N[CH](CNC(=O)c1ccnc(c1)C2=N[CH](CS2)C(O)=O)C(N)=O |
|
| Name: | ~{N}-[(2~{R})-2,3-bis(azanyl)-3-oxidanylidene-propyl]-2-[(4~{R})-4-methanoyl-4,5-dihydro-1,3-thiazol-2-yl]pyridine-4-carboxamide |
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