Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(N)c1ccc(cc1)n4nc(c3c4c2cnnc2cc3)C(=O)N |
SMILES_CANONICAL | CACTVS | 3.341 | NC(=O)c1nn(c2ccc(cc2)[S](N)(=O)=O)c3c4cn[nH]c4ccc13 |
SMILES | CACTVS | 3.341 | NC(=O)c1nn(c2ccc(cc2)[S](N)(=O)=O)c3c4cn[nH]c4ccc13 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C15H12N6O3S/c16-15(22)13-10-5-6-12-11(7-18-19-12)14(10)21(20-13)8-1-3-9(4-2-8)25(17,23)24/h1-7H,(H2,16,22)(H,18,19)(H2,17,23,24) |
InChIKey | InChI | 1.03 | HGAKLLFPOGATII-UHFFFAOYSA-N |