Vitas-M small molecule compound

3-[(1E)-1-(2-{[4-(2-chlorobenzyl)piperazin-1-ium-1-yl]acetyl}hydrazinylidene)ethyl]phenolate

Catalog ID
STL147882
SMILES [O-]c1cccc(c1)/C(=N/NC(=O)C[NH+]1CCN(CC1)Cc1ccccc1Cl)/C

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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 C21H25ClN4O2 MW 400.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN4O2/c1-16(17-6-4-7-19(27)13-17)23-24-21(28)15-26-11-9-25(10-12-26)14-18-5-2-3-8-20(18)22/h2-8,13,27H,9-12,14-15H2,1H3,(H,24,28)/b23-16+
InChIKey
WEAMOFBQHDRWBC-XQNSMLJCSA-N
Synonyms
315199-25-8
(O)c1cccc(c1)C(=NNC(=O)C(NH+)1CCN(CC1)Cc1ccccc1Cl)C
2(4((2CHLOROPHENYL)METHYL)PIPERAZIN1YL)N((E)1(3HYDROXYPHENYL)ETHYLIDENEAMINO)ACETAMIDE
3((1E)1(2((4(2chlorobenzyl)piperazin1ium1yl)acetyl)hydrazinylidene)ethyl)phenolate
315199258
CC(=NNC(=O)CN1CCN(CC1)CC2=CC=CC=C2Cl)C3=CC(=CC=C3)O
InChI=1SC21H25ClN4O2c116(1764719(27)1317)232421(28)152611925(101226)1418523820(18)22h281327H9121415H21H3(H2428)b2316+
MFCD03290878
ZINC000020065423
ZINC19826256

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Available files

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