PDB CCD ID: | SU2 |
Number of entries in BioLiP: | 2 |
Chemical formula: | C20 H21 N3 O2 |
InChI: | InChI=1S/C20H21N3O2/c24-14-22-9-11-23(12-10-22)16-7-5-15(6-8-16)13-18-17-3-1-2-4-19(17)21-20(18)25/h1-8,14,18H,9-13H2,(H,21,25) |
InChIKey: | AZGZGRJOCKSSHA-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.5.0 | c1ccc2c(c1)C(C(=O)N2)Cc3ccc(cc3)N4CCN(CC4)C=O | ACDLabs 10.04 | O=C2Nc1ccccc1C2Cc3ccc(cc3)N4CCN(C=O)CC4 | CACTVS 3.341 | O=CN1CCN(CC1)c2ccc(C[CH]3C(=O)Nc4ccccc34)cc2 | CACTVS 3.341 | O=CN1CCN(CC1)c2ccc(C[C@H]3C(=O)Nc4ccccc34)cc2 |
|
Name: | 3-[4-(1-FORMYLPIPERAZIN-4-YL)-BENZYLIDENYL]-2-INDOLINONE; SU4984 |
DrugBank: | DB02058 |