Vitas-M small molecule compound

N-(2,3-dihydro-1H-inden-1-yl)-5-(3,4-dimethoxyphenyl)-1H-pyrazole-4-carboxamide

Catalog ID
STL184874
SMILES COc1cc(ccc1OC)c1[nH]ncc1C(=O)NC1CCc2c1cccc2

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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 C21H21N3O3 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3/c1-26-18-10-8-14(11-19(18)27-2)20-16(12-22-24-20)21(25)23-17-9-7-13-5-3-4-6-15(13)17/h3-6,8,10-12,17H,7,9H2,1-2H3,(H,22,24)(H,23,25)
InChIKey
DCBDXZWXGHFABT-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)C2=C(C=NN2)C(=O)NC3CCC4=CC=CC=C34)OC
COc1cc(ccc1OC)c1(nH)ncc1C(=O)NC1CCc2c1cccc2
InChI=1SC21H21N3O3c1261810814(1119(18)272)2016(12222420)21(25)23179713534615(13)17h368101217H79H212H3(H2224)(H2325)
MFCD22387016
N(23dihydro1Hinden1yl)5(34dimethoxyphenyl)1Hpyrazole4carboxamide
ZINC000072329295
ZINC000072329296

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Available files

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