Vitas-M small molecule compound

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

Catalog ID
STK075220
SMILES CCCCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1c(C2=O)c(ccc1NC(=O)c1ccc(cc1)CCCCCC)OC(=O)c1ccc(cc1)CCCCCC)OC(=O)c1ccc(cc1)CCCCCC

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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 C66H74N2O8 MW 1023.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C66H74N2O8/c1-5-9-13-17-21-45-25-33-49(34-26-45)63(71)67-53-41-43-55(75-65(73)51-37-29-47(30-38-51)23-19-15-11-7-3)59-57(53)61(69)58-54(68-64(72)50-35-27-46(28-36-50)22-18-14-10-6-2)42-44-56(60(58)62(59)70)76-66(74)52-39-31-48(32-40-52)24-20-16-1
InChIKey
BLAYEPVKOXQXBO-UHFFFAOYSA-N
Synonyms

(45BIS((4HEXYLBENZOYL)AMINO)8(4HEXYLBENZOYL)OXY910DIOXOANTHRACEN1YL)4HEXYLBENZOATE
45BIS(((4HEXYLPHENYL)CARBONYL)AMINO)910DIOXO910DIHYDROANTHRACENE18DIYLBIS(4HEXYLBENZOATE)
45bis(4hexylbenzamido)910dioxo910dihydroanthracene18diylbis(4hexylbenzoate)
CCCCCCC1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)OC(=O)C4=CC=C(C=C4)CCCCCC)C(=O)C5=C(C=CC(=C5C3=O)NC(=O)C6=CC=C(C=C6)CCCCCC)OC(=O)C7=CC=C(C=C7)CCCCCC
CCCCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1c(C2=O)c(ccc1NC(=O)c1ccc(cc1)CCCCCC)OC(=O)c1ccc(cc1)CCCCCC)OC(=O)c1ccc(cc1)CCCCCC
InChI=1SC66H74N2O8c15913172145253349(342645)63(71)6753414355(7565(73)51372947(303851)2319151173)5957(53)61(69)5854(6864(72)50352746(283650)2218141062)424456(60(58)62(59)70)7666(74)52393148(324052)2420161284h2544H524H214H3(H6771)(H6872)
MFCD00982011
STK075220
ZINC150396445

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Available files

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