Vitas-M small molecule compound
3-(4-methoxyphenyl)-5-(3-nitrophenyl)-N-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK844510
SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])C(=S)Nc1ccccc1
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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 C23H20N4O3S MW 432.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3S/c1-30-20-12-10-16(11-13-20)21-15-22(17-6-5-9-19(14-17)27(28)29)26(25-21)23(31)24-18-7-3-2-4-8-18/h2-14,22H,15H2,1H3,(H,24,31)InChIKey
XRDBNOGVYMFXQD-UHFFFAOYSA-NSynonyms
394229-49-33(4methoxyphenyl)5(3nitrophenyl)Nphenyl45dihydro1Hpyrazole1carbothioamide
394229493
5(4METHOXYPHENYL)3(3NITROPHENYL)NPHENYL34DIHYDROPYRAZOLE2CARBOTHIOAMIDE
COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC(=CC=C3)(N+)(=O)(O))C(=S)NC4=CC=CC=C4
COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)(N+)(=O)(O))C(=S)Nc1ccccc1
InChI=1SC23H20N4O3Sc13020121016(111320)211522(1765919(1417)27(28)29)26(2521)23(31)24187324818h21422H15H21H3(H2431)
MFCD03671348
ZINC000001113166
ZINC000001113169
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