HIT ID: HIT104706856
Cas No: 345989-24-4
分子式: C20H15N5O3S
分子量: 405.43
常用名: MIND4-17
氢键受体数 (HBA): 9
氢键供体数 (HBD): 0
LogP: 3.9316
IUPAC: 5-nitro-2-{[5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}pyridine
IUPAC: 5-nitro-2-{[5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}pyridine
SMILES: [O-][N+](=O)c1ccc(Sc2nnc(COc3ccccc3)n2-c2ccccc2)nc1
SMILES: [O-][N+](=O)c1ccc(Sc2nnc(COc3ccccc3)n2-c2ccccc2)nc1
InChI key: OZUBDKIROJPQGE-UHFFFAOYSA-N
