Vitas-M small molecule compound
methyl (2Z)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]prop-2-enoate
Catalog ID
STK422785
SMILES COC(=O)/C(=C\c1c[nH]nc1c1ccc(c(c1)OC)OC)/C#N
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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 C16H15N3O4 MW 313.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O4/c1-21-13-5-4-10(7-14(13)22-2)15-12(9-18-19-15)6-11(8-17)16(20)23-3/h4-7,9H,1-3H3,(H,18,19)/b11-6-InChIKey
PSTUQTIPLKYRBN-WDZFZDKYSA-NSynonyms
COC(=O)C(=Cc1c(nH)nc1c1ccc(c(c1)OC)OC)C#N
COC1=C(C=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)OC)OC
InChI=1SC16H15N3O4c121135410(714(13)222)1512(9181915)611(817)16(20)233h479H13H3(H1819)b116
methyl(2Z)2cyano3(3(34dimethoxyphenyl)1Hpyrazol4yl)prop2enoate
METHYL(2Z)3(3(34DIMETHOXYPHENYL)PYRAZOL4YL)2CYANOPROP2ENOATE
methyl(Z)2cyano3(5(34dimethoxyphenyl)1Hpyrazol4yl)prop2enoate
MFCD02177156
ZINC000005728361
ZINC05728361
ZINC5728361
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