Vitas-M small molecule compound
5-(2,3-dihydro-1-benzofuran-5-yl)-N-(3,4-dimethoxybenzyl)-1H-pyrazole-3-carboxamide
Catalog ID
STL474326
SMILES COc1cc(CNC(=O)c2n[nH]c(c2)c2ccc3c(c2)CCO3)ccc1OC
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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 C21H21N3O4 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4/c1-26-19-5-3-13(9-20(19)27-2)12-22-21(25)17-11-16(23-24-17)14-4-6-18-15(10-14)7-8-28-18/h3-6,9-11H,7-8,12H2,1-2H3,(H,22,25)(H,23,24)InChIKey
ZUDLQADXXGNWHV-UHFFFAOYSA-NSynonyms
1491129-89-51491129895
3(23dihydro1benzofuran5yl)N((34dimethoxyphenyl)methyl)1Hpyrazole5carboxamide
3(23dihydrobenzofuran5yl)N(34dimethoxybenzyl)1Hpyrazole5carboxamide
5(23dihydro1benzofuran5yl)N(34dimethoxybenzyl)1Hpyrazole3carboxamide
COC1=C(C=C(C=C1)CNC(=O)C2=CC(=NN2)C3=CC4=C(C=C3)OCC4)OC
COc1cc(CNC(=O)c2(nH)nc(c2)c2ccc3c(c2)CCO3)ccc1OC
COc1cc(CNC(=O)c2n(nH)c(c2)c2ccc3c(c2)CCO3)ccc1OC
InChI=1SC21H21N3O4c126195313(920(19)272)122221(25)171116(232417)14461815(1014)782818h36911H7812H212H3(H2225)(H2324)
MFCD27963023
ZINC000096114268
ZINC96114268
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