Vitas-M small molecule compound

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

Catalog ID
STL348384
SMILES COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)C)c1ccc(cc1)C

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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 C26H26N2O2 MW 398.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2/c1-17-7-9-20(10-8-17)24-22-6-4-5-15-27-23(19-11-13-21(30-3)14-12-19)16-28(26(22)27)25(24)18(2)29/h7-14,16H,4-6,15H2,1-3H3
InChIKey
PQIPBZFBIJYHQV-UHFFFAOYSA-N
Synonyms
500144-74-1
1(4(4methoxyphenyl)1(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)ethanone
1(4(4methoxyphenyl)1(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulen2yl)ethanone
500144741
CC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)OC)C(=O)C
InChI=1SC26H26N2O2c1177920(10817)2422645152723(19111321(303)141219)1628(26(22)27)25(24)18(2)29h71416H4615H213H3
MFCD03304460
ZINC000005500872
ZINC05500872
ZINC5500872

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Available files

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