Vitas-M small molecule compound
2-{1-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)sulfonyl]piperidin-3-yl}-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL399711
SMILES CCn1nc(c(c1)S(=O)(=O)N1CCCC(C1)c1nn2c(n1)c1cnn(c1nc2)c1ccccc1)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 C23H25N9O2S MW 491.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N9O2S/c1-3-29-14-20(16(2)27-29)35(33,34)30-11-7-8-17(13-30)21-26-23-19-12-25-32(18-9-5-4-6-10-18)22(19)24-15-31(23)28-21/h4-6,9-10,12,14-15,17H,3,7-8,11,13H2,1-2H3InChIKey
XROIDWNKVFXZSG-UHFFFAOYSA-NSynonyms
1005625-40-01005625400
2(1((1ETHYL3METHYL1HPYRAZOL4YL)SULFONYL)PIPERIDIN3YL)7PHENYL7HPYRAZOLO(43E)(124)TRIAZOLO(15C)PYRIMIDINE
CCN1C=C(C(=N1)C)S(=O)(=O)N2CCCC(C2)C3=NN4C=NC5=C(C4=N3)C=NN5C6=CC=CC=C6
InChI=1SC23H25N9O2Sc13291420(16(2)2729)35(3334)30117817(1330)21262319122532(1895461018)22(19)241531(23)2821h4691012141517H3781113H212H3
MFCD04137960
ZINC000002809455
ZINC000002809456
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