Vitas-M small molecule compound
1-(4-fluorophenyl)-6,7-dimethoxy-N-{3-oxo-3-[(pyridin-4-ylmethyl)amino]propyl}-3,4-dihydroisoquinoline-2(1H)-carboxamide
Catalog ID
STK605278
SMILES COc1cc2c(cc1OC)CCN(C2c1ccc(cc1)F)C(=O)NCCC(=O)NCc1ccncc1
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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/c1-35-23-15-20-10-14-32(26(22(20)16-24(23)36-2)19-3-5-21(28)6-4-19)27(34)30-13-9-25(33)31-17-18-7-11-29-12-8-18/h3-8,11-12,15-16,26H,9-10,13-14,17H2,1-2H3,(H,30,34)(H,31,33)InChIKey
KCCDDAKCGRRKAO-UHFFFAOYSA-NSynonyms
921082-56-61(4fluorophenyl)67dimethoxyN(3oxo3((pyridin4ylmethyl)amino)propyl)34dihydroisoquinoline2(1H)carboxamide
1(4fluorophenyl)67dimethoxyN(3oxo3(pyridin4ylmethylamino)propyl)34dihydro1Hisoquinoline2carboxamide
921082566
COC1=C(C=C2C(N(CCC2=C1)C(=O)NCCC(=O)NCC3=CC=NC=C3)C4=CC=C(C=C4)F)OC
InChI=1SC27H29FN4O4c135231520101432(26(22(20)1624(23)362)193521(28)6419)27(34)3013925(33)3117187112912818h381112151626H910131417H212H3(H3034)(H3133)
MFCD08748318
ZINC000009340823
ZINC000009340825
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