HIT ID: HIT214433448
Cas No: 2762423-09-4
分子式: C33H32N2O5S
分子量: 568.69
常用名: ERα antagonist 1
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2E)-4-(3-{4-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophene-3-carbonyl]phenoxy}azetidin-1-yl)-1-(piperidin-1-yl)but-2-en-1-one
IUPAC: (2E)-4-(3-{4-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophene-3-carbonyl]phenoxy}azetidin-1-yl)-1-(piperidin-1-yl)but-2-en-1-one
SMILES: Oc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OC2CN(C\C=C\C(=O)N3CCCCC3)C2)cc1
SMILES: Oc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OC2CN(C\C=C\C(=O)N3CCCCC3)C2)cc1
InChI key: AOYIJENZQOCDLV-SNAWJCMRSA-N
