Vitas-M small molecule compound
4-{2-[(bicyclo[2.2.1]hept-5-en-2-ylmethyl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazine-1-carbaldehyde
Catalog ID
STL155533
SMILES O=CN1CCN(CC1)C1=C(C(=O)C1=O)NCC1CC2CC1C=C2
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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 C17H21N3O3 MW 315.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3/c21-10-19-3-5-20(6-4-19)15-14(16(22)17(15)23)18-9-13-8-11-1-2-12(13)7-11/h1-2,10-13,18H,3-9H2InChIKey
NZSQKGHEFZGPKH-UHFFFAOYSA-NSynonyms
1282121-82-71282121827
4(2((bicyclo(221)hept5en2ylmethyl)amino)34dioxocyclobut1en1yl)piperazine1carbaldehyde
4(2(5bicyclo(221)hept2enylmethylamino)34dioxocyclobuten1yl)piperazine1carbaldehyde
C1CN(CCN1C=O)C2=C(C(=O)C2=O)NCC3CC4CC3C=C4
InChI=1SC17H21N3O3c2110193520(6419)1514(16(22)17(15)23)189138111212(13)711h12101318H39H2
MFCD18797013
ZINC000101692242
ZINC000101692246
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