Vitas-M small molecule compound

butan-2-yl 6-(4-fluorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

Catalog ID
STK773602
SMILES CCC(OC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccc(cc1)F)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 C20H22FNO3 MW 343.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22FNO3/c1-4-11(2)25-20(24)19-12(3)18-16(22-19)9-14(10-17(18)23)13-5-7-15(21)8-6-13/h5-8,11,14,22H,4,9-10H2,1-3H3
InChIKey
UVRJQTZXCTVUQI-UHFFFAOYSA-N
Synonyms

butan2yl6(4fluorophenyl)3methyl4oxo1567tetrahydroindole2carboxylate
butan2yl6(4fluorophenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
CCC(C)OC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)F)C
CCC(OC(=O)c1(nH)c2c(c1C)C(=O)CC(C2)c1ccc(cc1)F)C
InChI=1SC20H22FNO3c1411(2)2520(24)1912(3)1816(2219)914(1017(18)23)135715(21)8613h58111422H4910H213H3
MFCD03855164
ZINC000000110822
ZINC000000110830

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.