Vitas-M small molecule compound
1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-N-(4H-1,2,4-triazol-3-yl)pyrrolidine-3-carboxamide
Catalog ID
STK654740
SMILES COc1cc(CCN2CC(CC2=O)C(=O)Nc2nnc[nH]2)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 C17H21N5O4 MW 359.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O4/c1-25-13-4-3-11(7-14(13)26-2)5-6-22-9-12(8-15(22)23)16(24)20-17-18-10-19-21-17/h3-4,7,10,12H,5-6,8-9H2,1-2H3,(H2,18,19,20,21,24)InChIKey
QTRMDXCGBOUJIQ-UHFFFAOYSA-NSynonyms
1081126-47-71(2(34dimethoxyphenyl)ethyl)5oxoN(1H124triazol5yl)pyrrolidine3carboxamide
1(2(34dimethoxyphenyl)ethyl)5oxoN(4H124triazol3yl)pyrrolidine3carboxamide
1(34dimethoxyphenethyl)5oxoN(1H124triazol3yl)pyrrolidine3carboxamide
1081126477
COC1=C(C=C(C=C1)CCN2CC(CC2=O)C(=O)NC3=NC=NN3)OC
COc1cc(CCN2CC(CC2=O)C(=O)Nc2n(nH)cn2)ccc1OC
COc1cc(CCN2CC(CC2=O)C(=O)Nc2nnc(nH)2)ccc1OC
InChI=1SC17H21N5O4c125134311(714(13)262)5622912(815(22)23)16(24)20171810192117h3471012H5689H212H3(H21819202124)
MFCD18167125
ZINC000020729451
ZINC000020729455
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