Vitas-M small molecule compound
(2R,3R,10bS)-3-[(4-fluorophenyl)carbonyl]-2-[4-(prop-2-en-1-yloxy)phenyl]-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Catalog ID
STK525336
SMILES C=CCOc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(cc2)F)N2[C@H](C1(C#N)C#N)c1ccccc1C=C2
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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 C30H22FN3O2 MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22FN3O2/c1-2-17-36-24-13-9-21(10-14-24)26-27(28(35)22-7-11-23(31)12-8-22)34-16-15-20-5-3-4-6-25(20)29(34)30(26,18-32)19-33/h2-16,26-27,29H,1,17H2/t26-,27+,29-/m0/s1InChIKey
NLNUPLDRTZKUMR-GKRYNVPLSA-NSynonyms
302901-59-3(2R3R10bS)2(4(allyloxy)phenyl)3(4fluorobenzoyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10bS)3((4fluorophenyl)carbonyl)2(4(prop2en1yloxy)phenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10bS)3(4fluorobenzoyl)2(4prop2enoxyphenyl)310bdihydro2Hpyrrolo(21a)isoquinoline11dicarbonitrile
302901593
C=CCOC1=CC=C(C=C1)C2C(N3C=CC4=CC=CC=C4C3C2(C#N)C#N)C(=O)C5=CC=C(C=C5)F
C=CCOc1ccc(cc1)(C@H)1(C@H)(C(=O)c2ccc(cc2)F)N2(C@H)(C1(C#N)C#N)c1ccccc1C=C2
InChI=1SC30H22FN3O2c1217362413921(101424)2627(28(35)2271123(31)12822)34161520534625(20)29(34)30(261832)1933h216262729H117H2t2627+29m0s1
ZINC000020792364
ZINC20792364
Check stock
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Check stock on Vitas-MAvailable files
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