Vitas-M small molecule compound

N-[9,10-dioxo-4-({[4-(4-pentylcyclohexyl)phenyl]carbonyl}amino)-9,10-dihydroanthracen-1-yl]-4-hexylbenzamide

Catalog ID
STK045785
SMILES CCCCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)NC(=O)c1ccc(cc1)C1CCC(CC1)CCCCC

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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 C45H50N2O4 MW 682.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C45H50N2O4/c1-3-5-7-9-13-31-18-22-34(23-19-31)44(50)46-38-28-29-39(41-40(38)42(48)36-14-10-11-15-37(36)43(41)49)47-45(51)35-26-24-33(25-27-35)32-20-16-30(17-21-32)12-8-6-4-2/h10-11,14-15,18-19,22-30,32H,3-9,12-13,16-17,20-21H2,1-2H3,(H,46,50)(H,4
InChIKey
ZENWFEVHNHHLNR-UHFFFAOYSA-N
Synonyms

CCCCCCC1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC(=O)C4=CC=C(C=C4)C5CCC(CC5)CCCCC)C(=O)C6=CC=CC=C6C3=O
CCCCCCc1ccc(cc1)C(=O)Nc1ccc(c2c1C(=O)c1ccccc1C2=O)NC(=O)c1ccc(cc1)C1CCC(CC1)CCCCC
InChI=1SC45H50N2O4c135791331182234(231931)44(50)4638282939(4140(38)42(48)361410111537(36)43(41)49)4745(51)35262433(252735)32201630(172132)128642h101114151819223032H39121316172021H212H3(H4650)(H4751)
MFCD00603672
N(910DIOXO4(((4(4PENTYLCYCLOHEXYL)PHENYL)CARBONYL)AMINO)910DIHYDROANTHRACEN1YL)4HEXYLBENZAMIDE
N(910DIOXO4((4(4PENTYLCYCLOHEXYL)BENZOYL)AMINO)ANTHRACEN1YL)4HEXYLBENZAMIDE
STK045785
ZINC000098044990
ZINC98044990

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Available files

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