HIT ID: HIT214318669
Cas No: 313971-05-0
分子式: C15H8ClN3O4
分子量: 329.7
常用名: ROCKII-IN-DI
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-(4-chloro-3-nitrophenyl)-4-[(pyridin-3-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
IUPAC: 2-(4-chloro-3-nitrophenyl)-4-[(pyridin-3-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
SMILES: Clc1ccc(cc1N(=O)=O)C1=NC(=Cc2cccnc2)C(=O)O1 |w:13.14,t:11|
SMILES: Clc1ccc(cc1N(=O)=O)C1=NC(=Cc2cccnc2)C(=O)O1 |w:13.14,t:11|
InChI key: UEHRUUYVLMTINQ-UHFFFAOYSA-N