Vitas-M small molecule compound

(2'S,3S,3'S,10b'R)-3'-[(4-chlorophenyl)carbonyl]-2'-[(4-fluorophenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one

Catalog ID
STK571796
SMILES Fc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)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 C33H22ClFN2O3 MW 549.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H22ClFN2O3/c34-22-13-9-21(10-14-22)30(39)28-27(29(38)20-11-15-23(35)16-12-20)33(25-7-3-4-8-26(25)36-32(33)40)31-24-6-2-1-5-19(24)17-18-37(28)31/h1-18,27-28,31H,(H,36,40)/t27-,28-,31+,33+/m0/s1
InChIKey
JVQXRKAHUKGXGY-TVNXZVQQSA-N
Synonyms
1177711-54-4
(1S2S3S10bR)3(4chlorobenzoyl)2(4fluorobenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3((4chlorophenyl)carbonyl)2((4fluorophenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(4chlorobenzoyl)2(4fluorobenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1177711544
C1=CC=C2C3C4(C(C(N3C=CC2=C1)C(=O)C5=CC=C(C=C5)Cl)C(=O)C6=CC=C(C=C6)F)C7=CC=CC=C7NC4=O
Fc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccc(cc2)Cl)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC33H22ClFN2O3c342213921(101422)30(39)2827(29(38)20111523(35)161220)33(25734826(25)3632(33)40)3124621519(24)171837(28)31h118272831H(H3640)t272831+33+m0s1
MFCD18245428
ZINC000101264671
ZINC101264671

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Available files

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