Vitas-M small molecule compound
(2E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-[3-(4-ethylphenyl)-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK473628
SMILES N#C/C(=C\c1c[nH]nc1c1ccc(cc1)CC)/C(=O)NCc1ccc2c(c1)OCO2
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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 C23H20N4O3 MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3/c1-2-15-3-6-17(7-4-15)22-19(13-26-27-22)10-18(11-24)23(28)25-12-16-5-8-20-21(9-16)30-14-29-20/h3-10,13H,2,12,14H2,1H3,(H,25,28)(H,26,27)/b18-10+InChIKey
RHAUHUSWVSCALY-VCHYOVAHSA-NSynonyms
(2E)N(13benzodioxol5ylmethyl)2cyano3(3(4ethylphenyl)1Hpyrazol4yl)prop2enamide
(2E)N(2HBENZO(34D)13DIOXOLAN5YLMETHYL)2CYANO3(3(4ETHYLPHENYL)PYRAZOL4YL)PROP2ENAMIDE
(E)N(13benzodioxol5ylmethyl)2cyano3(5(4ethylphenyl)1Hpyrazol4yl)prop2enamide
CCC1=CC=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NCC3=CC4=C(C=C3)OCO4
InChI=1SC23H20N4O3c12153617(7415)2219(13262722)1018(1124)23(28)251216582021(916)30142920h31013H21214H21H3(H2528)(H2627)b1810+
MFCD06162977
N#CC(=Cc1c(nH)nc1c1ccc(cc1)CC)C(=O)NCc1ccc2c(c1)OCO2
ZINC000017081847
ZINC17081847
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