Vitas-M small molecule compound

(2E)-2-cyano-N-(2-phenylethyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)prop-2-enamide

Catalog ID
STK431858
SMILES N#C/C(=C\c1c(C)nn(c1C)C)/C(=O)NCCc1ccccc1

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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 C18H20N4O MW 308.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O/c1-13-17(14(2)22(3)21-13)11-16(12-19)18(23)20-10-9-15-7-5-4-6-8-15/h4-8,11H,9-10H2,1-3H3,(H,20,23)/b16-11+
InChIKey
VPRMBNPCQILSKG-LFIBNONCSA-N
Synonyms

(2E)2cyanoN(2phenylethyl)3(135trimethyl1Hpyrazol4yl)prop2enamide
(2E)2CYANON(2PHENYLETHYL)3(135TRIMETHYLPYRAZOL4YL)PROP2ENAMIDE
(E)2cyanoN(2phenylethyl)3(135trimethylpyrazol4yl)prop2enamide
(E)2CYANONPHENETHYL3(135TRIMETHYLPYRAZOL4YL)PROP2ENAMIDE
CC1=C(C(=NN1C)C)C=C(C#N)C(=O)NCCC2=CC=CC=C2
InChI=1SC18H20N4Oc11317(14(2)22(3)2113)1116(1219)18(23)20109157546815h4811H910H213H3(H2023)b1611+
MFCD03466445
N#CC(=Cc1c(C)nn(c1C)C)C(=O)NCCc1ccccc1
ZINC000017031744
ZINC17031744

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Available files

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