Vitas-M small molecule compound

(2E)-N-[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]prop-2-enamide

Catalog ID
STK443453
SMILES COc1cc(/C=C/C(=O)Nc2nn(cc2Br)Cc2ccc(cc2)Cl)ccc1OC(C)C

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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 C23H23BrClN3O3 MW 504.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23BrClN3O3/c1-15(2)31-20-10-6-16(12-21(20)30-3)7-11-22(29)26-23-19(24)14-28(27-23)13-17-4-8-18(25)9-5-17/h4-12,14-15H,13H2,1-3H3,(H,26,27,29)/b11-7+
InChIKey
HWZMHSGQODAUCN-YRNVUSSQSA-N
Synonyms

(2E)N(4BROMO1((4CHLOROPHENYL)METHYL)PYRAZOL3YL)3(3METHOXY4(METHYLETHOXY)PHENYL)PROP2ENAMIDE
(2E)N(4bromo1(4chlorobenzyl)1Hpyrazol3yl)3(3methoxy4(propan2yloxy)phenyl)prop2enamide
(E)N(4bromo1((4chlorophenyl)methyl)pyrazol3yl)3(3methoxy4propan2yloxyphenyl)prop2enamide
CC(C)OC1=C(C=C(C=C1)C=CC(=O)NC2=NN(C=C2Br)CC3=CC=C(C=C3)Cl)OC
COc1cc(C=CC(=O)Nc2nn(cc2Br)Cc2ccc(cc2)Cl)ccc1OC(C)C
InChI=1SC23H23BrClN3O3c115(2)312010616(1221(20)303)71122(29)262319(24)1428(2723)13174818(25)9517h4121415H13H213H3(H262729)b117+
MFCD04054736
ZINC000020549983
ZINC20549983

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Available files

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