Vitas-M small molecule compound

(2E)-3-(4-benzylpiperazin-1-yl)-2-cyano-N-(4-methoxybenzyl)prop-2-enamide

Catalog ID
STK715962
SMILES COc1ccc(cc1)CNC(=O)/C(=C/N1CCN(CC1)Cc1ccccc1)/C#N

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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 C23H26N4O2 MW 390.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2/c1-29-22-9-7-19(8-10-22)16-25-23(28)21(15-24)18-27-13-11-26(12-14-27)17-20-5-3-2-4-6-20/h2-10,18H,11-14,16-17H2,1H3,(H,25,28)/b21-18+
InChIKey
MMDKPGRMHFWAQZ-DYTRJAOYSA-N
Synonyms
904007-44-9
(2E)3(4benzylpiperazin1yl)2cyanoN(4methoxybenzyl)prop2enamide
(E)3(4BENZYLPIPERAZIN1YL)2CYANON((4METHOXYPHENYL)METHYL)PROP2ENAMIDE
(E)3(4benzylpiperazin1yl)2cyanoN(4methoxybenzyl)acrylamide
904007449
COC1=CC=C(C=C1)CNC(=O)C(=CN2CCN(CC2)CC3=CC=CC=C3)C#N
COc1ccc(cc1)CNC(=O)C(=CN1CCN(CC1)Cc1ccccc1)C#N
InChI=1SC23H26N4O2c129229719(81022)162523(28)21(1524)1827131126(121427)17205324620h21018H11141617H21H3(H2528)b2118+
MFCD08292683
ZINC000019897667
ZINC19897667

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Available files

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