Vitas-M small molecule compound
1-[(4-{2-[3-(2,5-dimethylphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}phenyl)sulfonyl]piperidine
Catalog ID
STK672610
SMILES Cc1ccc(c(c1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])c1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCCCC1)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 C31H31N5O4S2 MW 601.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N5O4S2/c1-21-9-10-22(2)27(17-21)28-19-30(24-7-6-8-25(18-24)36(37)38)35(33-28)31-32-29(20-41-31)23-11-13-26(14-12-23)42(39,40)34-15-4-3-5-16-34/h6-14,17-18,20,30H,3-5,15-16,19H2,1-2H3InChIKey
UFVIHOHSUQULRF-UHFFFAOYSA-NSynonyms
1((4(2(3(25dimethylphenyl)5(3nitrophenyl)45dihydro1Hpyrazol1yl)13thiazol4yl)phenyl)sulfonyl)piperidine
2(5(25DIMETHYLPHENYL)3(3NITROPHENYL)34DIHYDROPYRAZOL2YL)4(4PIPERIDIN1YLSULFONYLPHENYL)13THIAZOLE
CC1=CC(=C(C=C1)C)C2=NN(C(C2)C3=CC(=CC=C3)(N+)(=O)(O))C4=NC(=CS4)C5=CC=C(C=C5)S(=O)(=O)N6CCCCC6
Cc1ccc(c(c1)C1=NN(C(C1)c1cccc(c1)(N+)(=O)(O))c1scc(n1)c1ccc(cc1)S(=O)(=O)N1CCCCC1)C
InChI=1SC31H31N5O4S2c12191022(2)27(1721)281930(2476825(1824)36(37)38)35(3328)313229(204131)23111326(141223)42(3940)34154351634h61417182030H35151619H212H3
MFCD00784983
ZINC000008442586
ZINC000008442587
Check stock
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Check stock on Vitas-MAvailable files
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