Vitas-M small molecule compound

(3-methyl-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)(phenyl)acetonitrile

Catalog ID
STK068950
SMILES N#CC(N1N=C(CC1c1ccccc1)C)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 C18H17N3 MW 275.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3/c1-14-12-17(15-8-4-2-5-9-15)21(20-14)18(13-19)16-10-6-3-7-11-16/h2-11,17-18H,12H2,1H3
InChIKey
HGBQDGFEQHUTSS-UHFFFAOYSA-N
Synonyms

(3METHYL5PHENYL45DIHYDRO1HPYRAZOL1YL)(PHENYL)ACETONITRILE
(3METHYL5PHENYL45DIHYDROPYRAZOL1YL)PHENYLACETONITRILE
2(3METHYL5PHENYL(2PYRAZOLINYL))2PHENYLETHANENITRILE
2(5METHYL3PHENYL34DIHYDROPYRAZOL2YL)2PHENYLACETONITRILE
CC1=NN(C(C1)C2=CC=CC=C2)C(C#N)C3=CC=CC=C3
InChI=1SC18H17N3c1141217(158425915)21(2014)18(1319)16106371116h2111718H12H21H3
MFCD02647270
N#CC(N1N=C(CC1c1ccccc1)C)c1ccccc1
STK068950
ZINC000000520086
ZINC000229921286

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Available files

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