Vitas-M small molecule compound

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

Catalog ID
STK573045
SMILES COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)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 C34H25FN2O4 MW 544.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25FN2O4/c1-41-24-16-12-21(13-17-24)30(38)28-29(31(39)22-10-14-23(35)15-11-22)37-19-18-20-6-2-3-7-25(20)32(37)34(28)26-8-4-5-9-27(26)36-33(34)40/h2-19,28-29,32H,1H3,(H,36,40)/t28-,29-,32+,34+/m0/s1
InChIKey
DYAKOWAVNCAHBL-GGKJBDKJSA-N
Synonyms
1177580-05-0
(1S2S3S10bR)3(4fluorobenzoyl)2(4methoxybenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3((4fluorophenyl)carbonyl)2((4methoxyphenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(4fluorobenzoyl)2(4methoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1177580050
COC1=CC=C(C=C1)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=C(C=C7)F
COc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccc(cc2)F)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC34H25FN2O4c14124161221(131724)30(38)2829(31(39)22101423(35)151122)37191820623725(20)32(37)34(28)26845927(26)3633(34)40h219282932H1H3(H3640)t282932+34+m0s1
MFCD18245460
ZINC000101309418
ZINC101309418

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Available files

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