Name: SHMT-IN-2
CAS#: 2102681-49-0
Chemical Formula: C22H24F3N5O
Exact Mass: 431.1933
Molecular Weight: 431.46
Elemental Analysis: C, 61.24; H, 5.61; F, 13.21; N, 16.23; O, 3.71
Description: SHMT-IN-2 is a serine hydroxymethyltransferase (SHMT) inhibitor, potently inhibiting both human SHMT1 and SHMT2. Note: this product was previously named as SHIN2.
IUPAC/Chemical Name: 6-Amino-4-isopropyl-3-methyl-4-(3-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
InChi Key: NOKJZHRLDAOFCV-UHFFFAOYSA-N
InChi Code: InChI=1S/C22H24F3N5O/c1-12(2)21(17(11-26)19(27)31-20-18(21)13(3)28-29-20)14-8-15(22(23,24)25)10-16(9-14)30-6-4-5-7-30/h8-10,12H,4-7,27H2,1-3H3,(H,28,29)
SMILES Code: N#CC(C1(C(C)C)C2=CC(C(F)(F)F)=CC(N3CCCC3)=C2)=C(N)OC4=C1C(C)=NN4
Appearance: Solid powder
關(guān)鍵字： 2102681-49-0;SHMT-IN-2;
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