Vitas-M small molecule compound

3-(4-methoxyphenyl)-5-(3-nitrophenyl)-1-(phenylsulfonyl)-4,5-dihydro-1H-pyrazole

Catalog ID
STK836993
SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)[N+](=O)[O-])S(=O)(=O)c1ccccc1

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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 C22H19N3O5S MW 437.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O5S/c1-30-19-12-10-16(11-13-19)21-15-22(17-6-5-7-18(14-17)25(26)27)24(23-21)31(28,29)20-8-3-2-4-9-20/h2-14,22H,15H2,1H3
InChIKey
GUYKIOYRAHHBRK-UHFFFAOYSA-N
Synonyms
337482-95-8
2(BENZENESULFONYL)5(4METHOXYPHENYL)3(3NITROPHENYL)34DIHYDROPYRAZOLE
3(4methoxyphenyl)5(3nitrophenyl)1(phenylsulfonyl)45dihydro1Hpyrazole
337482958
5(3NITROPHENYL)3(4METHOXYPHENYL)1(PHENYLSULFONYL)45DIHYDRO1HPYRAZOLE
COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC(=CC=C3)(N+)(=O)(O))S(=O)(=O)C4=CC=CC=C4
COc1ccc(cc1)C1=NN(C(C1)c1cccc(c1)(N+)(=O)(O))S(=O)(=O)c1ccccc1
InChI=1SC22H19N3O5Sc13019121016(111319)211522(1765718(1417)25(26)27)24(2321)31(2829)208324920h21422H15H21H3
MFCD02046140
ZINC000000856227
ZINC000000856230

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Available files

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