| PDB CCD ID: | NXP |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C18 H18 N6 O |
| InChI: | InChI=1S/C18H18N6O/c1-11(23-24-18(19)20)12-6-8-13(9-7-12)22-17(25)15-10-21-16-5-3-2-4-14(15)16/h2-10,21H,1H3,(H,22,25)(H4,19,20,24)/b23-11+ |
| InChIKey: | BTFCNWPQBVODIL-FOKLQQMPSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | O=C(c2c1ccccc1nc2)Nc3ccc(\C(=N\NC(=[N@H])N)C)cc3 | | OpenEye OEToolkits 1.7.0 | C/C(=N\NC(=N)N)/c1ccc(cc1)NC(=O)c2c[nH]c3c2cccc3 | | CACTVS 3.370 | CC(=NNC(N)=N)c1ccc(NC(=O)c2c[nH]c3ccccc23)cc1 | | OpenEye OEToolkits 1.7.0 | CC(=NNC(=N)N)c1ccc(cc1)NC(=O)c2c[nH]c3c2cccc3 | | CACTVS 3.370 | CC(=N\NC(N)=N)/c1ccc(NC(=O)c2c[nH]c3ccccc23)cc1 |
|
| Name: | N-{4-[(1E)-N-CARBAMIMIDOYLETHANEHYDRAZONOYL]PHENYL}-1H-INDOLE-3-CARBOXAMIDE |
| ZINC: | ZINC000098209248 |
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