Vitas-M small molecule compound
4-(3,4-dimethylphenyl)-2-[3-(2,5-dimethylphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole
Catalog ID
STK758388
SMILES Cc1ccc(c(c1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])c1scc(n1)c1ccc(c(c1)C)C)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 C28H26N4O2S MW 482.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O2S/c1-17-8-9-19(3)24(12-17)25-15-27(22-6-5-7-23(14-22)32(33)34)31(30-25)28-29-26(16-35-28)21-11-10-18(2)20(4)13-21/h5-14,16,27H,15H2,1-4H3InChIKey
XXUJTMJCKBATCR-UHFFFAOYSA-NSynonyms
4(34dimethylphenyl)2(3(25dimethylphenyl)5(3nitrophenyl)45dihydro1Hpyrazol1yl)13thiazole
4(34DIMETHYLPHENYL)2(5(25DIMETHYLPHENYL)3(3NITROPHENYL)34DIHYDROPYRAZOL2YL)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)C)C
Cc1ccc(c(c1)C1=NN(C(C1)c1cccc(c1)(N+)(=O)(O))c1scc(n1)c1ccc(c(c1)C)C)C
InChI=1SC28H26N4O2Sc1178919(3)24(1217)251527(2265723(1422)32(33)34)31(3025)282926(163528)21111018(2)20(4)1321h5141627H15H214H3
MFCD01414400
ZINC000008407232
ZINC000008407235
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