Vitas-M small molecule compound

bis{3-[2-(tritylamino)ethyl]-1H-indol-5-yl} (2E)-but-2-enedioate

Catalog ID
STK366261
SMILES O=C(Oc1ccc2c(c1)c(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)c[nH]2)/C=C/C(=O)Oc1ccc2c(c1)c(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)c[nH]2

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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 C62H52N4O4 MW 917.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C62H52N4O4/c67-59(69-53-31-33-57-55(41-53)45(43-63-57)37-39-65-61(47-19-7-1-8-20-47,48-21-9-2-10-22-48)49-23-11-3-12-24-49)35-36-60(68)70-54-32-34-58-56(42-54)46(44-64-58)38-40-66-62(50-25-13-4-14-26-50,51-27-15-5-16-28-51)52-29-17-6-18-30-52/h1-
InChIKey
BWWHHUZFPMKGDT-ULDVOPSXSA-N
Synonyms

bis(3(2(tritylamino)ethyl)1Hindol5yl)(2E)but2enedioate
bis(3(2(tritylamino)ethyl)1Hindol5yl)(E)but2enedioate
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NCCC4=CNC5=C4C=C(C=C5)OC(=O)C=CC(=O)OC6=CC7=C(C=C6)NC=C7CCNC(C8=CC=CC=C8)(C9=CC=CC=C9)C1=CC=CC=C1
DI3(2((TRIPHENYLMETHYL)AMINO)ETHYL)INDOL5YL(2E)BUT2ENE14DIOATE
InChI=1SC62H52N4O4c6759(695331335755(4153)45(436357)37396561(47197182047482192102248)4923113122449)353660(68)705432345856(4254)46(446458)38406662(50251341426505127155162851)5229176183052h13641446366H3740H2b3635+
MFCD00308289
O=C(Oc1ccc2c(c1)c(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)c(nH)2)C=CC(=O)Oc1ccc2c(c1)c(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)c(nH)2
ZINC000150390485
ZINC150390485

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Available files

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