Vitas-M small molecule compound
9-(difluoromethyl)-7-methyl-2-{1-[(3-nitrophenyl)sulfonyl]piperidin-4-yl}pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STL174450
SMILES FC(c1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)C1CCN(CC1)S(=O)(=O)c1cccc(c1)[N+](=O)[O-])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 C23H19F2N7O4S2 MW 559.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19F2N7O4S2/c1-12-9-16(20(24)25)27-23-17(12)18-19(37-23)22-28-21(29-31(22)11-26-18)13-5-7-30(8-6-13)38(35,36)15-4-2-3-14(10-15)32(33)34/h2-4,9-11,13,20H,5-8H2,1H3InChIKey
JUTUNBDVBSOJDZ-UHFFFAOYSA-NSynonyms
881488-08-0881488080
9(difluoromethyl)7methyl2(1((3nitrophenyl)sulfonyl)piperidin4yl)pyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)C5CCN(CC5)S(=O)(=O)C6=CC=CC(=C6)(N+)(=O)(O))C(F)F
FC(c1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)C1CCN(CC1)S(=O)(=O)c1cccc(c1)(N+)(=O)(O))F
InChI=1SC23H19F2N7O4S2c112916(20(24)25)272317(12)1819(3723)222821(2931(22)112618)135730(8613)38(3536)1542314(1015)32(33)34h249111320H58H21H3
MFCD08554529
ZINC000098046188
ZINC98046188
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