Vitas-M small molecule compound
6-[2-(4-chlorophenoxy)propan-2-yl]-3-[5-(2-methylpropyl)-1H-pyrazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK632973
SMILES CC(Cc1[nH]nc(c1)c1nnc2n1nc(s2)C(Oc1ccc(cc1)Cl)(C)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H21ClN6OS MW 416.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN6OS/c1-11(2)9-13-10-15(22-21-13)16-23-24-18-26(16)25-17(28-18)19(3,4)27-14-7-5-12(20)6-8-14/h5-8,10-11H,9H2,1-4H3,(H,21,22)InChIKey
UPYKRZOOXOLJHY-UHFFFAOYSA-NSynonyms
1160227-28-01160227280
6(2(4chlorophenoxy)propan2yl)3(3isobutyl1Hpyrazol5yl)(124)triazolo(34b)(134)thiadiazole
6(2(4chlorophenoxy)propan2yl)3(5(2methylpropyl)1Hpyrazol3yl)(124)triazolo(34b)(134)thiadiazole
CC(C)CC1=CC(=NN1)C2=NN=C3N2N=C(S3)C(C)(C)OC4=CC=C(C=C4)Cl
CC(Cc1(nH)nc(c1)c1nnc2n1nc(s2)C(Oc1ccc(cc1)Cl)(C)C)C
CC(Cc1cc((nH)n1)c1nnc2n1nc(s2)C(Oc1ccc(cc1)Cl)(C)C)C
InChI=1SC19H21ClN6OSc111(2)9131015(222113)1623241826(16)2517(2818)19(34)27147512(20)6814h581011H9H214H3(H2122)
MFCD18159951
ZINC000012323674
ZINC12323674
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