Vitas-M small molecule compound

methyl 6-({[1-(4-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}amino)hexanoate

Catalog ID
STK991577
SMILES COC(=O)CCCCCNC(=O)N1CCc2c(C1c1ccc(cc1)F)cc(c(c2)OC)OC

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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 C25H31FN2O5 MW 458.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31FN2O5/c1-31-21-15-18-12-14-28(25(30)27-13-6-4-5-7-23(29)33-3)24(20(18)16-22(21)32-2)17-8-10-19(26)11-9-17/h8-11,15-16,24H,4-7,12-14H2,1-3H3,(H,27,30)
InChIKey
ZNKGQFFHRSRXIV-UHFFFAOYSA-N
Synonyms
921143-07-9
921143079
COC1=C(C=C2C(N(CCC2=C1)C(=O)NCCCCCC(=O)OC)C3=CC=C(C=C3)F)OC
InChI=1SC25H31FN2O5c131211518121428(25(30)2713645723(29)333)24(20(18)1622(21)322)1781019(26)11917h811151624H471214H213H3(H2730)
methyl6(((1(4fluorophenyl)67dimethoxy34dihydroisoquinolin2(1H)yl)carbonyl)amino)hexanoate
methyl6((1(4fluorophenyl)67dimethoxy34dihydro1Hisoquinoline2carbonyl)amino)hexanoate
methyl6(1(4fluorophenyl)67dimethoxy1234tetrahydroisoquinoline2carboxamido)hexanoate
MFCD08747933
ZINC000009306812
ZINC000009306813

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Available files

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