Vitas-M small molecule compound

1-[4-(4-chlorophenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-yl]ethanone

Catalog ID
STK997900
SMILES Cc1ccc(cc1)c1c(C(=O)C)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl

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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 C25H23ClN2O MW 402.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN2O/c1-16-6-8-19(9-7-16)23-21-5-3-4-14-27-22(18-10-12-20(26)13-11-18)15-28(25(21)27)24(23)17(2)29/h6-13,15H,3-5,14H2,1-2H3
InChIKey
OQIGTFKJYKAJNU-UHFFFAOYSA-N
Synonyms
488137-91-3
1(4(4chlorophenyl)1(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)ethanone
1(4(4chlorophenyl)1(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)ethanone
488137913
CC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)Cl)C(=O)C
InChI=1SC25H23ClN2Oc1166819(9716)2321534142722(18101220(26)131118)1528(25(21)27)24(23)17(2)29h61315H3514H212H3
MFCD03290392
ZINC000002335106
ZINC02335106
ZINC2335106

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Available files

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