Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C20H18N2O3S/c23-18(24)11-20(9-13-5-1-2-6-14(13)10-20)19(25)21-12-17-22-15-7-3-4-8-16(15)26-17/h1-8H,9-12H2,(H,21,25)(H,23,24) |
InChIKey | InChI | 1.03 | OYMIHDNBNWVHIU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CC1(Cc2ccccc2C1)C(=O)NCc3sc4ccccc4n3 |
SMILES | CACTVS | 3.385 | OC(=O)CC1(Cc2ccccc2C1)C(=O)NCc3sc4ccccc4n3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CC(C2)(CC(=O)O)C(=O)NCc3nc4ccccc4s3 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)CC(C2)(CC(=O)O)C(=O)NCc3nc4ccccc4s3 |