Vitas-M small molecule compound

2-(4-butylcyclohexyl)-6-(octylamino)-7H-benzo[e]perimidin-7-one

Catalog ID
STK022709
SMILES CCCCCCCCNc1ccc2c3c1C(=O)c1ccccc1c3nc(n2)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 C33H43N3O MW 497.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H43N3O/c1-3-5-7-8-9-12-22-34-27-20-21-28-29-30(27)32(37)26-15-11-10-14-25(26)31(29)36-33(35-28)24-18-16-23(17-19-24)13-6-4-2/h10-11,14-15,20-21,23-24,34H,3-9,12-13,16-19,22H2,1-2H3
InChIKey
XGZYKZWRJXGDBK-UHFFFAOYSA-N
Synonyms

2(4BUTYLCYCLOHEXYL)6(OCTYLAMINO)7HBENZO(E)PERIMIDIN7ONE
2(4BUTYLCYCLOHEXYL)6(OCTYLAMINO)BENZO(E)PERIMIDIN7ONE
CCCCCCCCNC1=C2C3=C(C=C1)N=C(N=C3C4=CC=CC=C4C2=O)C5CCC(CC5)CCCC
CCCCCCCCNc1ccc2c3c1C(=O)c1ccccc1c3nc(n2)C1CCC(CC1)CCCC
InChI=1SC33H43N3Oc135789122234272021282930(27)32(37)261511101425(26)31(29)3633(3528)24181623(171924)13642h101114152021232434H391213161922H212H3
MFCD08049918
STK022709
ZINC000098044780
ZINC98044780

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Available files

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