Vitas-M small molecule compound

(2E)-N-benzyl-2-cyano-3-[4-(4-fluorophenyl)piperazin-1-yl]prop-2-enamide

Catalog ID
STK829043
SMILES N#C/C(=C\N1CCN(CC1)c1ccc(cc1)F)/C(=O)NCc1ccccc1

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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 C21H21FN4O MW 364.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN4O/c22-19-6-8-20(9-7-19)26-12-10-25(11-13-26)16-18(14-23)21(27)24-15-17-4-2-1-3-5-17/h1-9,16H,10-13,15H2,(H,24,27)/b18-16+
InChIKey
HCMGCRJEPOSGNM-FBMGVBCBSA-N
Synonyms
899377-34-5
(2E)Nbenzyl2cyano3(4(4fluorophenyl)piperazin1yl)prop2enamide
(E)Nbenzyl2cyano3(4(4fluorophenyl)piperazin1yl)acrylamide
(E)NBENZYL2CYANO3(4(4FLUOROPHENYL)PIPERAZIN1YL)PROP2ENAMIDE
899377345
C1CN(CCN1C=C(C#N)C(=O)NCC2=CC=CC=C2)C3=CC=C(C=C3)F
InChI=1SC21H21FN4Oc22196820(9719)26121025(111326)1618(1423)21(27)2415174213517h1916H101315H2(H2427)b1816+
MFCD07642765
N#CC(=CN1CCN(CC1)c1ccc(cc1)F)C(=O)NCc1ccccc1
ZINC000005487381
ZINC05487381
ZINC5487381

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Available files

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