化学生物学
选项
-
1,5-二(4-甲氧苯基)戊-1,4-二烯-3-酮分子式: C19H18O3 分子量: 294.34IUPAC Name: (1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-oneSMILES: COC1=CC=C(C=C1)C=CC(=O)C=CC2=CC=C(C=C2)OCInChIKey: IOZVKDXPBWBUKY-LQIBPGRFSA-NInChI: InChI=1S/C19H18O3/c1-21-18-11-5-15(6-12-18)3-9-17(20)10-4-16-7-13-19(22-2)14-8-16/h3-14H,1-2H3/b9-3+,10-4+
-
7-氯-1,2,3,4-四氢异喹啉CAS号 : 82771-60-6 Compound CID : 12595069分子式: C9H10ClN 分子量: 167.6IUPAC Name: 7-chloro-1,2,3,4-tetrahydroisoquinolineSMILES: C1CNCC2=C1C=CC(=C2)ClInChIKey: BLRKQLICTKRDDZ-UHFFFAOYSA-NInChI: InChI=1S/C9H10ClN/c10-9-2-1-7-3-4-11-6-8(7)5-9/h1-2,5,11H,3-4,6H2
-
8-氯-1,2,3,4-四氢异喹啉CAS号 : 75416-50-1 Compound CID : 12595071分子式: C9H10ClN 分子量: 167.64IUPAC Name: 8-chloro-1,2,3,4-tetrahydroisoquinolineSMILES: C1CNCC2=C1C=CC=C2ClInChIKey: HQSAGIBNZOOQQL-UHFFFAOYSA-NInChI: InChI=1S/C9H10ClN/c10-9-3-1-2-7-4-5-11-6-8(7)9/h1-3,11H,4-6H2
-
7-硝基-1,2,3,4-四氢异喹啉CAS号 : 42923-79-5 Compound CID : 6424833分子式: C9H10N2O2 分子量: 178.19IUPAC Name: 7-nitro-1,2,3,4-tetrahydroisoquinolineSMILES: C1CNCC2=C1C=CC(=C2)[N+](=O)[O-]InChIKey: YPRWYZSUBZXORL-UHFFFAOYSA-NInChI: InChI=1S/C9H10N2O2/c12-11(13)9-2-1-7-3-4-10-6-8(7)5-9/h1-2,5,10H,3-4,6H2
-
外消旋托法替尼CAS号 : 1259404-17-5 Compound CID : 9926791分子式: C16H20N6O 分子量: 312.377IUPAC Name: 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrileSMILES: CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#NInChIKey: UJLAWZDWDVHWOW-YPMHNXCESA-NInChI: InChI=1S/C16H20N6O/c1-11-5-8-22(14(23)3-6-17)9-13(11)21(2)16-12-4-7-18-15(12)19-10-20-16/h4,7,10-11,13H,3,5,8-9H2,1-2H3,(H,18,19,20)/t11-,13+/m1/s1