Vitas-M small molecule compound
1-(4-fluorophenyl)-6,7-dimethoxy-N-{3-oxo-3-[(pyridin-3-ylmethyl)amino]propyl}-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STK611952
SMILES COc1cc2c(cc1OC)CCN(C2c1ccc(cc1)F)C(=O)NCCC(=O)NCc1cccnc1
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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 C27H29FN4O4 MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29FN4O4/c1-35-23-14-20-10-13-32(26(22(20)15-24(23)36-2)19-5-7-21(28)8-6-19)27(34)30-12-9-25(33)31-17-18-4-3-11-29-16-18/h3-8,11,14-16,26H,9-10,12-13,17H2,1-2H3,(H,30,34)(H,31,33)InChIKey
AUABPFRLTCEZOU-UHFFFAOYSA-NSynonyms
921152-90-11(4fluorophenyl)67dimethoxyN(3oxo3((pyridin3ylmethyl)amino)propyl)34dihydroisoquinoline2(1H)carboxamide
1(4fluorophenyl)67dimethoxyN(3oxo3(pyridin3ylmethylamino)propyl)34dihydro1Hisoquinoline2carboxamide
921152901
COC1=C(C=C2C(N(CCC2=C1)C(=O)NCCC(=O)NCC3=CN=CC=C3)C4=CC=C(C=C4)F)OC
InChI=1SC27H29FN4O4c135231420101332(26(22(20)1524(23)362)195721(28)8619)27(34)3012925(33)3117184311291618h3811141626H910121317H212H3(H3034)(H3133)
MFCD08746306
ZINC000009303541
ZINC000009303543
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