Vitas-M small molecule compound
methyl 1-[(4'-chloro-1,1'',3,3''-tetramethyl-1H,1'H,1''H-4,3':5',4''-terpyrazol-1'-yl)methyl]-1H-pyrazole-3-carboxylate
Catalog ID
STL413056
SMILES COC(=O)c1ccn(n1)Cn1nc(c(c1c1cn(nc1C)C)Cl)c1cn(nc1C)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 C19H21ClN8O2 MW 428.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN8O2/c1-11-13(8-25(3)21-11)17-16(20)18(14-9-26(4)22-12(14)2)28(24-17)10-27-7-6-15(23-27)19(29)30-5/h6-9H,10H2,1-5H3InChIKey
QNVRBZWIFHDZLP-UHFFFAOYSA-NSynonyms
1006327-76-91006327769
CC1=NN(C=C1C2=C(C(=NN2CN3C=CC(=N3)C(=O)OC)C4=CN(N=C4C)C)Cl)C
InChI=1SC19H21ClN8O2c11113(825(3)2111)1716(20)18(14926(4)2212(14)2)28(2417)10277615(2327)19(29)305h69H10H215H3
methyl1((4chloro1133tetramethyl1H1H1H4354terpyrazol1yl)methyl)1Hpyrazole3carboxylate
methyl1((4chloro35bis(13dimethylpyrazol4yl)pyrazol1yl)methyl)pyrazole3carboxylate
MFCD08553108
ZINC000036611597
ZINC36611597
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