Vitas-M small molecule compound

(2E,6E)-2,6-bis(1H-indol-3-ylmethylidene)-4-methylcyclohexanone

Catalog ID
STK541937
SMILES CC1C/C(=C\c2c[nH]c3c2cccc3)/C(=O)/C(=C/c2c[nH]c3c2cccc3)/C1

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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 C25H22N2O MW 366.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O/c1-16-10-17(12-19-14-26-23-8-4-2-6-21(19)23)25(28)18(11-16)13-20-15-27-24-9-5-3-7-22(20)24/h2-9,12-16,26-27H,10-11H2,1H3/b17-12+,18-13+
InChIKey
JMKCRJHKKHIYIH-PWDIZTEBSA-N
Synonyms
488087-54-3
(2E6E)26bis((1Hindol3yl)methylene)4methylcyclohexanone
(2E6E)26BIS(1HINDOL3YLMETHYLIDENE)4METHYLCYCLOHEXAN1ONE
(2E6E)26bis(1Hindol3ylmethylidene)4methylcyclohexanone
488087543
CC1CC(=CC2=CNC3=CC=CC=C32)C(=O)C(=CC4=CNC5=CC=CC=C54)C1
CC1CC(=Cc2c(nH)c3c2cccc3)C(=O)C(=Cc2c(nH)c3c2cccc3)C1
InChI=1SC25H22N2Oc1161017(1219142623842621(19)23)25(28)18(1116)1320152724953722(20)24h2912162627H1011H21H3b1712+1813+
MFCD03287727
ZINC000004898638
ZINC39327474
ZINC4898638

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Available files

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