Vitas-M small molecule compound

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

Catalog ID
STK810554
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)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/c33-30-11-5-4-8-25(30)22-40-29-14-12-24(13-15-29)31-27(21-38(37-31)28-9-2-1-3-10-28)17-26(18-34)32(39)36-20-23-7-6-16-35-19-23/h1-17,19,21H,20,22H2,(H,36,39)/b26-17+
InChIKey
VLKCPDDGLIFTFL-YZSQISJMSA-N
Synonyms

(2E)3(3(4((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2cyanoN(pyridin3ylmethyl)prop2enamide
(2E)3(3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYL1HPYRAZOL4YL)2CYANON(PYRIDIN3YLMETHYL)PROP2ENAMIDE
(E)3(3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2CYANON(PYRIDIN3YLMETHYL)PROP2ENAMIDE
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C=C(C#N)C(=O)NCC5=CN=CC=C5
InChI=1SC32H24ClN5O2c33301154825(30)224029141224(131529)3127(2138(3731)2892131028)1726(1834)32(39)3620237616351923h1171921H2022H2(H3639)b2617+
MFCD04480354
N#CC(=Cc1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)C(=O)NCc1cccnc1
ZINC000097946424
ZINC97946424

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Available files

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