Vitas-M small molecule compound
3-(4-{2-[(2-hydroxyethyl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazin-1-yl)propanenitrile
Catalog ID
STL153112
SMILES OCCNC1=C(C(=O)C1=O)N1CCN(CC1)CCC#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 C13H18N4O3 MW 278.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N4O3/c14-2-1-4-16-5-7-17(8-6-16)11-10(15-3-9-18)12(19)13(11)20/h15,18H,1,3-9H2InChIKey
XKPJOABZUWDHOM-UHFFFAOYSA-NSynonyms
1282141-15-41282141154
3(4(2((2hydroxyethyl)amino)34dioxocyclobut1en1yl)piperazin1yl)propanenitrile
3(4(2(2hydroxyethylamino)34dioxocyclobuten1yl)piperazin1yl)propanenitrile
C1CN(CCN1CCC#N)C2=C(C(=O)C2=O)NCCO
InChI=1SC13H18N4O3c14214165717(8616)1110(153918)12(19)13(11)20h1518H139H2
MFCD18797694
ZINC000101694495
ZINC101694495
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