1MPS1-IN-1 ,1125593-20-5 _Chemical Cloud Database

1MPS1-IN-1

Basic Information
Product Name：	1MPS1-IN-1
CAS：	1125593-20-5
English Synonyms：	MPS1-IN-1 ; 1-(4-(4-(2-(ISOPROPYLSULFONYL)PHENYLAMINO)-1H-PYRROLO[2,3-B]PYRIDIN-6-YLAMINO)-3-METHOXYPHENYL)PIPERIDIN-4-OL ; MPS1 INHIBITOR ; 1MPS1-IN-1
MDL Number.：	MFCD22124489
H bond acceptor：	9
H bond donor：	4
Smile：	CC(C)S(=O)(=O)c1ccccc1Nc2cc(nc3c2cc[nH]3)Nc4ccc(cc4OC)N5CCC(CC5)O
InChi：	InChI=1S/C28H33N5O4S/c1-18(2)38(35,36)26-7-5-4-6-23(26)30-24-17-27(32-28-21(24)10-13-29-28)31-22-9-8-19(16-25(22)37-3)33-14-11-20(34)12-15-33/h4-10,13,16-18,20,34H,11-12,14-15H2,1-3H3,(H3,29,30,31,32)
InChiKey：	InChIKey=NMJMRSQTDLRCRQ-UHFFFAOYSA-N

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