Vitas-M small molecule compound

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

Catalog ID
STK585267
SMILES COc1ccc(c(c1)OC)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)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 C35H28N2O5 MW 556.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H28N2O5/c1-41-23-16-17-25(28(20-23)42-2)32(39)30-29(31(38)22-11-4-3-5-12-22)35(26-14-8-9-15-27(26)36-34(35)40)33-24-13-7-6-10-21(24)18-19-37(30)33/h3-20,29-30,33H,1-2H3,(H,36,40)/t29-,30-,33+,35+/m0/s1
InChIKey
GUOZSEQPGIWKNU-CXNUKBDRSA-N
Synonyms
1212425-89-2
(1S2S3S10bR)2benzoyl3(24dimethoxybenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)2benzoyl3(24dimethoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
(2S3S3S10bR)3((24dimethoxyphenyl)carbonyl)2(phenylcarbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
1212425892
COC1=CC(=C(C=C1)C(=O)C2C(C3(C4N2C=CC5=CC=CC=C45)C6=CC=CC=C6NC3=O)C(=O)C7=CC=CC=C7)OC
COc1ccc(c(c1)OC)C(=O)(C@H)1N2C=Cc3c((C@@H)2(C@@)2((C@@H)1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3
InChI=1SC35H28N2O5c14123161725(28(2023)422)32(39)3029(31(38)22114351222)35(2614891527(26)3634(35)40)332413761021(24)181937(30)33h320293033H12H3(H3640)t293033+35+m0s1
MFCD18158274
ZINC000101669629
ZINC101669629

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Available files

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