Vitas-M small molecule compound

(2Z)-2-cyano-3-[3-(4-methoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide

Catalog ID
STK798873
SMILES N#C/C(=C/c1cn(nc1c1ccc(c(c1)C)OC)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 C27H23N5O2 MW 449.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O2/c1-19-13-21(10-11-25(19)34-2)26-23(18-32(31-26)24-8-4-3-5-9-24)14-22(15-28)27(33)30-17-20-7-6-12-29-16-20/h3-14,16,18H,17H2,1-2H3,(H,30,33)/b22-14-
InChIKey
GJCOWJSRGCQDMT-HMAPJEAMSA-N
Synonyms

(2Z)2cyano3(3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)N(pyridin3ylmethyl)prop2enamide
(Z)2CYANO3(3(4METHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)N(PYRIDIN3YLMETHYL)PROP2ENAMIDE
CC1=C(C=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4)OC
InChI=1SC27H23N5O2c1191321(101125(19)342)2623(1832(3126)248435924)1422(1528)27(33)3017207612291620h3141618H17H212H3(H3033)b2214
MFCD03462116
N#CC(=Cc1cn(nc1c1ccc(c(c1)C)OC)c1ccccc1)C(=O)NCc1cccnc1
ZINC000016700538
ZINC16700538

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Available files

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