Vitas-M small molecule compound

methyl N-{[1-(2-fluorophenyl)-6,7-dimethoxy-1,4-dihydroindeno[1,2-c]pyrazol-3-yl]carbonyl}valinate

Catalog ID
STK938528
SMILES COC(=O)C(C(C)C)NC(=O)c1nn(c2c1Cc1c2cc(c(c1)OC)OC)c1ccccc1F

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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 C25H26FN3O5 MW 467.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26FN3O5/c1-13(2)21(25(31)34-5)27-24(30)22-16-10-14-11-19(32-3)20(33-4)12-15(14)23(16)29(28-22)18-9-7-6-8-17(18)26/h6-9,11-13,21H,10H2,1-5H3,(H,27,30)
InChIKey
RTFVXEHREIDJFQ-UHFFFAOYSA-N
Synonyms

CC(C)C(C(=O)OC)NC(=O)C1=NN(C2=C1CC3=CC(=C(C=C32)OC)OC)C4=CC=CC=C4F
InChI=1SC25H26FN3O5c113(2)21(25(31)345)2724(30)221610141119(323)20(334)1215(14)23(16)29(2822)18976817(18)26h69111321H10H215H3(H2730)
methyl2((1(2fluorophenyl)67dimethoxy4Hindeno(12c)pyrazole3carbonyl)amino)3methylbutanoate
methyl2(1(2fluorophenyl)67dimethoxy14dihydroindeno(12c)pyrazole3carboxamido)3methylbutanoate
methylN((1(2fluorophenyl)67dimethoxy14dihydroindeno(12c)pyrazol3yl)carbonyl)valinate
MFCD13755433
ZINC000036352543
ZINC000036352545

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Available files

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