Vitas-M small molecule compound
(2R,3R,10bS)-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-2-[4-(trifluoromethyl)phenyl]-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Catalog ID
STK757043
SMILES N#CC1(C#N)[C@@H](c2ccc(cc2)C(F)(F)F)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)C12CC3CC(C2)CC(C1)C3
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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 C32H28F3N3O MW 527.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28F3N3O/c33-32(34,35)24-7-5-23(6-8-24)26-27(29(39)30-14-19-11-20(15-30)13-21(12-19)16-30)38-10-9-22-3-1-2-4-25(22)28(38)31(26,17-36)18-37/h1-10,19-21,26-28H,11-16H2/t19?,20?,21?,26-,27+,28-,30?/m0/s1InChIKey
ARFYGPJMUJGDQO-BSVVFNILSA-NSynonyms
293320-01-1(2R3R10bS)3((1s3S)adamantane1carbonyl)2(4(trifluoromethyl)phenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10BS)3(ADAMANTANE1CARBONYL)2(4(TRIFLUOROMETHYL)PHENYL)310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
(2R3R10bS)3(tricyclo(3311~37~)dec1ylcarbonyl)2(4(trifluoromethyl)phenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
293320011
C1C2CC3CC1CC(C2)(C3)C(=O)C4C(C(C5N4C=CC6=CC=CC=C56)(C#N)C#N)C7=CC=C(C=C7)C(F)(F)F
InChI=1SC32H28F3N3Oc3332(3435)247523(6824)2627(29(39)3014191120(1530)1321(1219)1630)3810922312425(22)28(38)31(261736)1837h11019212628H1116H2t19?20?21?2627+2830?m0s1
MFCD13372092
N#CC1(C#N)(C@@H)(c2ccc(cc2)C(F)(F)F)(C@@H)(N2(C@H)1c1ccccc1C=C2)C(=O)C12CC3CC(C2)CC(C1)C3
ZINC000097949519
ZINC97949519
Check stock
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