Vitas-M small molecule compound
(8R,8aS,11aR)-N-(4-chlorophenyl)-10-(2-fluorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8-carboxamide
Catalog ID
STK551203
SMILES Clc1ccc(cc1)NC(=O)[C@@H]1N2N=Cc3c(C2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1F)cccc3
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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 C26H18ClFN4O3 MW 488.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18ClFN4O3/c27-15-9-11-16(12-10-15)30-24(33)23-21-20(22-17-6-2-1-5-14(17)13-29-32(22)23)25(34)31(26(21)35)19-8-4-3-7-18(19)28/h1-13,20-23H,(H,30,33)/t20-,21+,22?,23-/m1/s1InChIKey
GFZPXBABWOHJKR-HNTVYWHESA-NSynonyms
1014082-32-6(8R8aS11aR)N(4chlorophenyl)10(2fluorophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine8carboxamide
1014082326
C1=CC=C2C3C4C(C(N3N=CC2=C1)C(=O)NC5=CC=C(C=C5)Cl)C(=O)N(C4=O)C6=CC=CC=C6F
Clc1ccc(cc1)NC(=O)(C@@H)1N2N=Cc3c(C2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccccc1F)cccc3
InChI=1SC26H18ClFN4O3c271591116(121015)3024(33)232120(2217621514(17)132932(22)23)25(34)31(26(21)35)19843718(19)28h1132023H(H3033)t2021+22?23m1s1
MFCD18242573
ZINC000009076217
ZINC000009076218
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