Vitas-M small molecule compound

(2E)-3-(3-{4-[(4-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-(pyridin-3-ylmethyl)prop-2-enamide

Catalog ID
STK810594
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccc(cc1)Cl)c1ccccc1)/C(=O)NCc1cccnc1

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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 C32H24ClN5O2 MW 546.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24ClN5O2/c33-28-12-8-23(9-13-28)22-40-30-14-10-25(11-15-30)31-27(21-38(37-31)29-6-2-1-3-7-29)17-26(18-34)32(39)36-20-24-5-4-16-35-19-24/h1-17,19,21H,20,22H2,(H,36,39)/b26-17+
InChIKey
AGOWGEKIWPTHQU-YZSQISJMSA-N
Synonyms

(2E)3(3(4((4chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2cyanoN(pyridin3ylmethyl)prop2enamide
(2E)3(3(4((4CHLOROPHENYL)METHOXY)PHENYL)1PHENYL1HPYRAZOL4YL)2CYANON(PYRIDIN3YLMETHYL)PROP2ENAMIDE
(E)3(3(4((4CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2CYANON(PYRIDIN3YLMETHYL)PROP2ENAMIDE
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl)C=C(C#N)C(=O)NCC5=CN=CC=C5
InChI=1SC32H24ClN5O2c332812823(91328)224030141025(111530)3127(2138(3731)296213729)1726(1834)32(39)3620245416351924h1171921H2022H2(H3639)b2617+
MFCD04495721
N#CC(=Cc1cn(nc1c1ccc(cc1)OCc1ccc(cc1)Cl)c1ccccc1)C(=O)NCc1cccnc1
ZINC000097946325
ZINC97946325

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Available files

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