Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(N)(=O)c1nnc(NC(=O)CC2CCCCC2)s1 |
InChI | InChI | 1.06 | InChI=1S/C10H16N4O3S2/c11-19(16,17)10-14-13-9(18-10)12-8(15)6-7-4-2-1-3-5-7/h7H,1-6H2,(H2,11,16,17)(H,12,13,15) |
InChIKey | InChI | 1.06 | JUBREXAVHBVMRO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1sc(NC(=O)CC2CCCCC2)nn1 |
SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1sc(NC(=O)CC2CCCCC2)nn1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CCC(CC1)CC(=O)Nc2nnc(s2)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | C1CCC(CC1)CC(=O)Nc2nnc(s2)S(=O)(=O)N |