Vitas-M small molecule compound
9-(difluoromethyl)-7-methyl-2-[(5-phenyl-2H-tetrazol-2-yl)methyl]pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL174418
SMILES FC(c1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)Cn1nnc(n1)c1ccccc1)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 C20H13F2N9S MW 449.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13F2N9S/c1-10-7-12(17(21)22)24-20-14(10)15-16(32-20)19-25-13(27-30(19)9-23-15)8-31-28-18(26-29-31)11-5-3-2-4-6-11/h2-7,9,17H,8H2,1H3InChIKey
JKKISHHLUHQZQO-UHFFFAOYSA-NSynonyms
881481-03-4881481034
9(difluoromethyl)7methyl2((5phenyl2Htetrazol2yl)methyl)pyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)CN5N=C(N=N5)C6=CC=CC=C6)C(F)F
InChI=1SC20H13F2N9Sc110712(17(21)22)242014(10)1516(3220)192513(2730(19)92315)8312818(262931)115324611h27917H8H21H3
MFCD08554217
ZINC000013644088
ZINC13644088
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