Vitas-M small molecule compound
(2Z)-3-[3-(4-butoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(1-phenylethyl)prop-2-enamide
Catalog ID
STK810727
SMILES CCCCOc1ccc(c(c1)C)c1nn(cc1/C=C(\C(=O)NC(c1ccccc1)C)/C#N)c1ccccc1
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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 C32H32N4O2 MW 504.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O2/c1-4-5-18-38-29-16-17-30(23(2)19-29)31-27(22-36(35-31)28-14-10-7-11-15-28)20-26(21-33)32(37)34-24(3)25-12-8-6-9-13-25/h6-17,19-20,22,24H,4-5,18H2,1-3H3,(H,34,37)/b26-20-InChIKey
ODUQNTPYQFHDLE-QOMWVZHYSA-NSynonyms
(2Z)3(3(4butoxy2methylphenyl)1phenyl1Hpyrazol4yl)2cyanoN(1phenylethyl)prop2enamide
(Z)3(3(4butoxy2methylphenyl)1phenylpyrazol4yl)2cyanoN(1phenylethyl)prop2enamide
CCCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NC(C)C3=CC=CC=C3)C4=CC=CC=C4)C
CCCCOc1ccc(c(c1)C)c1nn(cc1C=C(C(=O)NC(c1ccccc1)C)C#N)c1ccccc1
InChI=1SC32H32N4O2c145183829161730(23(2)1929)3127(2236(3531)2814107111528)2026(2133)32(37)3424(3)25128691325h61719202224H4518H213H3(H3437)b2620
MFCD04555402
ZINC000016804873
ZINC000016804875
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