Vitas-M small molecule compound
N-(4-cyano-1H-pyrazol-3-yl)-N'-[2-(3,4-dimethoxyphenyl)ethyl]ethanediamide
Catalog ID
STK632470
SMILES COc1cc(CCNC(=O)C(=O)Nc2n[nH]cc2C#N)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 C16H17N5O4 MW 343.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O4/c1-24-12-4-3-10(7-13(12)25-2)5-6-18-15(22)16(23)20-14-11(8-17)9-19-21-14/h3-4,7,9H,5-6H2,1-2H3,(H,18,22)(H2,19,20,21,23)InChIKey
JTWHLXBKFAGVQX-UHFFFAOYSA-NSynonyms
1107056-77-81107056778
COC1=C(C=C(C=C1)CCNC(=O)C(=O)NC2=C(C=NN2)C#N)OC
COc1cc(CCNC(=O)C(=O)Nc2(nH)ncc2C#N)ccc1OC
COc1cc(CCNC(=O)C(=O)Nc2n(nH)cc2C#N)ccc1OC
InChI=1SC16H17N5O4c124124310(713(12)252)561815(22)16(23)201411(817)9192114h3479H56H212H3(H1822)(H219202123)
MFCD18159790
N(4cyano1Hpyrazol3yl)N(2(34dimethoxyphenyl)ethyl)ethanediamide
N(4cyano1Hpyrazol5yl)N(2(34dimethoxyphenyl)ethyl)oxamide
N1(4cyano1Hpyrazol5yl)N2(34dimethoxyphenethyl)oxalamide
ZINC000012323809
ZINC12323809
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