Vitas-M small molecule compound
(2E)-N-[1-(1H-benzimidazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Catalog ID
STL186158
SMILES COc1cc(/C=C/C(=O)Nc2cc(nn2c2nc3c([nH]2)cccc3)C)cc(c1OC)OC
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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 C23H23N5O4 MW 433.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O4/c1-14-11-20(28(27-14)23-24-16-7-5-6-8-17(16)25-23)26-21(29)10-9-15-12-18(30-2)22(32-4)19(13-15)31-3/h5-13H,1-4H3,(H,24,25)(H,26,29)/b10-9+InChIKey
HOWVXCJDQSFCPH-MDZDMXLPSA-NSynonyms
(2E)N(1(1Hbenzimidazol2yl)3methyl1Hpyrazol5yl)3(345trimethoxyphenyl)prop2enamide
(E)N(2(1HBENZIMIDAZOL2YL)5METHYLPYRAZOL3YL)3(345TRIMETHOXYPHENYL)PROP2ENAMIDE
CC1=NN(C(=C1)NC(=O)C=CC2=CC(=C(C(=C2)OC)OC)OC)C3=NC4=CC=CC=C4N3
COc1cc(C=CC(=O)Nc2cc(nn2c2nc3c((nH)2)cccc3)C)cc(c1OC)OC
InChI=1SC23H23N5O4c1141120(28(2714)232416756817(16)2523)2621(29)109151218(302)22(324)19(1315)313h513H14H3(H2425)(H2629)b109+
MFCD05261041
ZINC000009636050
ZINC09636050
ZINC9636050
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