Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3,5-dinitropyridine
Catalog ID
STK759123
SMILES [O-][N+](=O)c1cc(cnc1Sc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)[N+](=O)[O-]
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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 C23H20N6O4S MW 476.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N6O4S/c1-23(2,3)16-11-9-15(10-12-16)20-25-26-22(27(20)17-7-5-4-6-8-17)34-21-19(29(32)33)13-18(14-24-21)28(30)31/h4-14H,1-3H3InChIKey
KIMGPONDUUOCAI-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(cnc1Sc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)(N+)(=O)(O)
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)35DINITROPYRIDINE
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)35BISNITROPYRIDINE
2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)35dinitropyridine
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SC4=C(C=C(C=N4)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC23H20N6O4Sc123(23)1611915(101216)20252622(27(20)177546817)342119(29(32)33)1318(142421)28(30)31h414H13H3
MFCD01460761
ZINC000008407931
ZINC08407931
ZINC8407931
Check stock
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