Vitas-M small molecule compound
2-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL391570
SMILES Clc1ccc(cc1)c1[nH]nc(c1)c1nn2c(n1)c1sc3c(c1nc2)c(C)cc(n3)C(F)F
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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 C21H12ClF2N7S MW 467.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12ClF2N7S/c1-9-6-13(18(23)24)26-21-15(9)16-17(32-21)20-27-19(30-31(20)8-25-16)14-7-12(28-29-14)10-2-4-11(22)5-3-10/h2-8,18H,1H3,(H,28,29)InChIKey
HSXMWHMLFBYFPZ-UHFFFAOYSA-NSynonyms
1092791-52-01092791520
2(5(4chlorophenyl)1Hpyrazol3yl)9(difluoromethyl)7methylpyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)C5=CC(=NN5)C6=CC=C(C=C6)Cl)C(F)F
Clc1ccc(cc1)c1(nH)nc(c1)c1nn2c(n1)c1sc3c(c1nc2)c(C)cc(n3)C(F)F
InChI=1SC21H12ClF2N7Sc19613(18(23)24)262115(9)1617(3221)202719(3031(20)82516)14712(282914)102411(22)5310h2818H1H3(H2829)
MFCD08553914
ZINC000022579697
ZINC22579697
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