Vitas-M small molecule compound

3-methyl-1-(4-nitrophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole

Catalog ID
STK096453
SMILES CC1=NN(C(C1)c1ccccc1)c1ccc(cc1)[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 C16H15N3O2 MW 281.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O2/c1-12-11-16(13-5-3-2-4-6-13)18(17-12)14-7-9-15(10-8-14)19(20)21/h2-10,16H,11H2,1H3
InChIKey
AZTNKGFJYVATPK-UHFFFAOYSA-N
Synonyms
34326-52-8
34326528
3METHYL1(4NITROPHENYL)5PHENYL2PYRAZOLINE
3METHYL1(4NITROPHENYL)5PHENYL45DIHYDRO1HPYRAZOLE
5METHYL2(4NITROPHENYL)3PHENYL34DIHYDROPYRAZOLE
CC1=NN(C(C1)c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
CC1=NN(C(C1)C2=CC=CC=C2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H15N3O2c1121116(135324613)18(1712)147915(10814)19(20)21h21016H11H21H3
MFCD00227600
STK096453
ZINC000004017594
ZINC000004017595

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.