Vitas-M small molecule compound
4-(2-{[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperazine-1-carbaldehyde
Catalog ID
STL158896
SMILES O=CN1CCN(CC1)C1=C(C(=O)C1=O)NCC(c1ccc(cc1)OC)N1CCCC1
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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 C22H28N4O4 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O4/c1-30-17-6-4-16(5-7-17)18(25-8-2-3-9-25)14-23-19-20(22(29)21(19)28)26-12-10-24(15-27)11-13-26/h4-7,15,18,23H,2-3,8-14H2,1H3InChIKey
KNTSLWYYROXPTI-UHFFFAOYSA-NSynonyms
1282114-40-21282114402
4(2((2(4methoxyphenyl)2(pyrrolidin1yl)ethyl)amino)34dioxocyclobut1en1yl)piperazine1carbaldehyde
4(2((2(4methoxyphenyl)2pyrrolidin1ylethyl)amino)34dioxocyclobuten1yl)piperazine1carbaldehyde
COC1=CC=C(C=C1)C(CNC2=C(C(=O)C2=O)N3CCN(CC3)C=O)N4CCCC4
InChI=1SC22H28N4O4c130176416(5717)18(25823925)14231920(22(29)21(19)28)26121024(1527)111326h47151823H23814H21H3
MFCD18797924
ZINC000101695055
ZINC000101695060
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