HIT ID: HIT214480373
Cas No: 1315459-30-3
分子式: C20H21N3O2
分子量: 335.407
常用名: TIS108
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6-phenoxy-1-phenyl-2-(1H-1,2,4-triazol-1-yl)hexan-1-one
IUPAC: 6-phenoxy-1-phenyl-2-(1H-1,2,4-triazol-1-yl)hexan-1-one
SMILES: O=C(C(CCCCOc1ccccc1)n1cncn1)c1ccccc1
SMILES: O=C(C(CCCCOc1ccccc1)n1cncn1)c1ccccc1
InChI key: PCSREBFOVZSWQV-UHFFFAOYSA-N