化学式

CAS号

IUPAC Name

4-[[4-[2-[[3-[3-(chloroamino)-3-甲基丁氧基]-3-甲基丁基]氨基]-2-氧代乙基]哌嗪-1-基]甲基]-N-[4-甲基-3-[(4-吡啶-3-基嘧啶-2-基)氨基]苯基]苯甲酰胺 4-[[4-[2-[[3-[3-(chloroamino)-3-methylbutoxy]-3-methylbutyl]amino]-2-oxoethyl]piperazin-1-yl]methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide

InChI

InChI=1S/C40H52ClN9O3/c1-29-8-13-33(25-35(29)47-38-44-18-14-34(46-38)32-7-6-17-42-26-32)45-37(52)31-11-9-30(10-12-31)27-49-20-22-50(23-21-49)28-36(51)43-19-15-40(4,5)53-24-16-39(2,3)48-41/h6-14,17-18,25-26,48H,15-16,19-24,27-28H2,1-5H3,(H,43,51)(H,45,52)(H,44,46,47)

InChI Key

ASHVTTSNKXKJFK-UHFFFAOYSA-N

Canonical SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3CCN(CC3)CC(=O)NCCC(C)(C)OCCC(C)(C)NCl)NC4=NC=CC(=N4)C5=CN=CC=C5

别名