Vitas-M small molecule compound
5-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)-3-{[4-(propan-2-yl)phenyl]sulfonyl}thieno[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine
Catalog ID
STL192840
SMILES CC(c1ccc(cc1)S(=O)(=O)c1nnn2c1nc(N1CCC(=CC1)c1ccccc1)c1c2ccs1)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 C27H25N5O2S2 MW 515.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S2/c1-18(2)19-8-10-22(11-9-19)36(33,34)27-26-28-25(24-23(14-17-35-24)32(26)30-29-27)31-15-12-21(13-16-31)20-6-4-3-5-7-20/h3-12,14,17-18H,13,15-16H2,1-2H3InChIKey
ZKTQTSZRZZJFSO-UHFFFAOYSA-NSynonyms
931972-02-05(4phenyl36dihydropyridin1(2H)yl)3((4(propan2yl)phenyl)sulfonyl)thieno(23e)(123)triazolo(15a)pyrimidine
931972020
CC(C)C1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=C(N3N=N2)C=CS4)N5CCC(=CC5)C6=CC=CC=C6
InChI=1SC27H25N5O2S2c118(2)1981022(11919)36(3334)27262825(2423(14173524)32(26)302927)31151221(131631)206435720h312141718H131516H212H3
MFCD14898957
ZINC000009116975
ZINC9116975
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