Vitas-M small molecule compound

3-(4-acetylpiperazin-1-yl)-4-{[2-(4-hydroxyphenyl)ethyl]amino}cyclobut-3-ene-1,2-dione

Catalog ID
STL154868
SMILES Oc1ccc(cc1)CCNC1=C(C(=O)C1=O)N1CCN(CC1)C(=O)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 C18H21N3O4 MW 343.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O4/c1-12(22)20-8-10-21(11-9-20)16-15(17(24)18(16)25)19-7-6-13-2-4-14(23)5-3-13/h2-5,19,23H,6-11H2,1H3
InChIKey
CONDCYYPJMWHHK-UHFFFAOYSA-N
Synonyms
1282096-46-1
1282096461
3(4acetylpiperazin1yl)4((2(4hydroxyphenyl)ethyl)amino)cyclobut3ene12dione
3(4acetylpiperazin1yl)4((4hydroxyphenethyl)amino)cyclobut3ene12dione
3(4acetylpiperazin1yl)4(2(4hydroxyphenyl)ethylamino)cyclobut3ene12dione
CC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)NCCC3=CC=C(C=C3)O
InChI=1SC18H21N3O4c112(22)2081021(11920)1615(17(24)18(16)25)1976132414(23)5313h251923H611H21H3
MFCD18799656
ZINC000101701533
ZINC101701533

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Available files

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