BGB-3111(1633350-06-7)名称与标识符
名称
英文别名:
7-(1-acryloylpiperidin-4-yl)-2-(4-phenoxyphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;BGB3111;(+/-)-Zanubrutinib;((plusmn))-Zanubrutinib;2-(4-phenoxyphenyl)-7-(1-prop-2-enoylpiperidin-4-yl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide;BDBM249900;BCP25045;BCP25838;NSC799318;SB18877;( inverted exclamation markA)-Zanubrutinib;US9447106, 27;C(C=C)(=O)N1CCC(CC1)C1CCNC=2N1N=C(C;(±)-Zanubrutinib;
标识符
InChIKey:
RNOAOAWBMHREKO-UHFFFAOYSA-N
Inchi:
1S/C27H29N5O3/c1-2-23(33)31-16-13-18(14-17-31)22-12-15-29-27-24(26(28)34)25(30-32(22)27)19-8-10-21(11-9-19)35-20-6-4-3-5-7-20/h2-11,18,22,29H,1,12-17H2,(H2,28,34)
SMILES:
O=C(C([H])=C([H])[H])N1C([H])([H])C([H])([H])C([H])(C([H])([H])C1([H])[H])C1([H])C([H])([H])C([H])([H])N([H])C2=C(C(N([H])[H])=O)C(C3C([H])=C([H])C(=C([H])C=3[H])OC3C([H])=C([H])C([H])=C([H])C=3[H])=NN12