Vitas-M small molecule compound

2-(1-butyl-2,6-dimethylpyridin-4(1H)-ylidene)-1H-indene-1,3(2H)-dione

Catalog ID
STK987612
SMILES CCCCn1c(C)c/c(=C/2\C(=O)c3c(C2=O)cccc3)/cc1C

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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 C20H21NO2 MW 307.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO2/c1-4-5-10-21-13(2)11-15(12-14(21)3)18-19(22)16-8-6-7-9-17(16)20(18)23/h6-9,11-12H,4-5,10H2,1-3H3
InChIKey
OWERSDNWUSEOGN-UHFFFAOYSA-N
Synonyms

2(1BUTYL26DIMETHYL4HYDROPYRIDYLIDENE)CYCLOPENTA(12A)BENZENE13DIONE
2(1BUTYL26DIMETHYL4PYRIDINYLIDENE)INDENE13DIONE
2(1BUTYL26DIMETHYL4PYRIDYLIDENE)INDANE13QUINONE
2(1butyl26dimethylpyridin4(1H)ylidene)1Hindene13(2H)dione
2(1BUTYL26DIMETHYLPYRIDIN4YLIDENE)INDENE13DIONE
CCCCN1C(=CC(=C2C(=O)C3=CC=CC=C3C2=O)C=C1C)C
CCCCn1c(C)cc(=C2C(=O)c3c(C2=O)cccc3)cc1C
InChI=1SC20H21NO2c145102113(2)1115(1214(21)3)1819(22)16867917(16)20(18)23h691112H4510H213H3
MFCD03041840
ZINC000002667036
ZINC2667036

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Available files

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