Vitas-M small molecule compound

4,5-bis{[(4-butylphenyl)carbonyl]amino}-9,10-dioxo-9,10-dihydroanthracene-1,8-diyl bis(4-butylbenzoate)

Catalog ID
STK009106
SMILES CCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1c(C2=O)c(ccc1NC(=O)c1ccc(cc1)CCCC)OC(=O)c1ccc(cc1)CCCC)OC(=O)c1ccc(cc1)CCCC

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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 C58H58N2O8 MW 911.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C58H58N2O8/c1-5-9-13-37-17-25-41(26-18-37)55(63)59-45-33-35-47(67-57(65)43-29-21-39(22-30-43)15-11-7-3)51-49(45)53(61)50-46(60-56(64)42-27-19-38(20-28-42)14-10-6-2)34-36-48(52(50)54(51)62)68-58(66)44-31-23-40(24-32-44)16-12-8-4/h17-36H,5-16H2,1-4
InChIKey
TUURDWYVPMIMQB-UHFFFAOYSA-N
Synonyms
5308-92-9
(45BIS((4BUTYLBENZOYL)AMINO)8(4BUTYLBENZOYL)OXY910DIOXOANTHRACEN1YL)4BUTYLBENZOATE
45BIS(((4BUTYLPHENYL)CARBONYL)AMINO)910DIOXO910DIHYDROANTHRACENE18DIYLBIS(4BUTYLBENZOATE)
45bis(4butylbenzamido)910dioxo910dihydroanthracene18diylbis(4butylbenzoate)
5308929
CCCCC1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)OC(=O)C4=CC=C(C=C4)CCCC)C(=O)C5=C(C=CC(=C5C3=O)NC(=O)C6=CC=C(C=C6)CCCC)OC(=O)C7=CC=C(C=C7)CCCC
CCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1c(C2=O)c(ccc1NC(=O)c1ccc(cc1)CCCC)OC(=O)c1ccc(cc1)CCCC)OC(=O)c1ccc(cc1)CCCC
InChI=1SC58H58N2O8c1591337172541(261837)55(63)5945333547(6757(65)43292139(223043)151173)5149(45)53(61)5046(6056(64)42271938(202842)141062)343648(52(50)54(51)62)6858(66)44312340(243244)161284h1736H516H214H3(H5963)(H6064)
MFCD00601770
STK009106
ZINC000150396574
ZINC150396574

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Available files

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