Vitas-M small molecule compound

N-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-1'-ethyl-3',5'-dimethyl-1'H,2H-3,4'-bipyrazole-5-carboxamide

Catalog ID
STL577885
SMILES COc1cc2CCC(c2cc1OC)NC(=O)c1n[nH]c(c1)c1c(C)nn(c1C)CC

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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 C22H27N5O3 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O3/c1-6-27-13(3)21(12(2)26-27)17-11-18(25-24-17)22(28)23-16-8-7-14-9-19(29-4)20(30-5)10-15(14)16/h9-11,16H,6-8H2,1-5H3,(H,23,28)(H,24,25)
InChIKey
DOMZJAKCVBGEKO-UHFFFAOYSA-N
Synonyms

COc1cc2CCC(c2cc1OC)NC(=O)c1(nH)nc(c1)c1c(C)nn(c1C)CC
InChI=1SC22H27N5O3c162713(3)21(12(2)2627)171118(252417)22(28)23168714919(294)20(305)1015(14)16h91116H68H215H3(H2328)(H2425)
MFCD33396696
N(56dimethoxy23dihydro1Hinden1yl)1ethyl35dimethyl1H1H(34bipyrazole)5carboxamide
N(56dimethoxy23dihydro1Hinden1yl)1ethyl35dimethyl1H2H34bipyrazole5carboxamide

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Available files

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