Vitas-M small molecule compound
N-[2-(1H-benzimidazol-1-yl)ethyl]-5-(3,4-dimethoxyphenyl)-1H-pyrazole-3-carboxamide
Catalog ID
STL411522
SMILES COc1cc(ccc1OC)c1[nH]nc(c1)C(=O)NCCn1cnc2c1cccc2
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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 C21H21N5O3 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O3/c1-28-19-8-7-14(11-20(19)29-2)16-12-17(25-24-16)21(27)22-9-10-26-13-23-15-5-3-4-6-18(15)26/h3-8,11-13H,9-10H2,1-2H3,(H,22,27)(H,24,25)InChIKey
JLLPOYRVGKGQAS-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)NCCN3C=NC4=CC=CC=C43)OC
COc1cc(ccc1OC)c1(nH)nc(c1)C(=O)NCCn1cnc2c1cccc2
COc1cc(ccc1OC)c1n(nH)c(c1)C(=O)NCCn1cnc2c1cccc2
InChI=1SC21H21N5O3c128198714(1120(19)292)161217(252416)21(27)2291026132315534618(15)26h381113H910H212H3(H2227)(H2425)
MFCD28578347
N(2(1Hbenzimidazol1yl)ethyl)5(34dimethoxyphenyl)1Hpyrazole3carboxamide
N(2(1Hbenzo(d)imidazol1yl)ethyl)3(34dimethoxyphenyl)1Hpyrazole5carboxamide
N(2(benzimidazol1yl)ethyl)3(34dimethoxyphenyl)1Hpyrazole5carboxamide
ZINC000096232009
ZINC96232009
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