Vitas-M small molecule compound

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

Catalog ID
STK591086
SMILES COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)OC)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/c1-41-24-15-11-22(12-16-24)31(38)29-30(32(39)23-13-17-25(42-2)18-14-23)37-20-19-21-7-3-4-8-26(21)33(37)35(29)27-9-5-6-10-28(27)36-34(35)40/h3-20,29-30,33H,1-2H3,(H,36,40)/t29-,30-,33+,35+/m0/s1
InChIKey
UPWSJIGLLFTRFO-CXNUKBDRSA-N
Synonyms
1212264-29-3
((1S2S3S10bR)2oxo310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinoline)23diyl)bis((4methoxyphenyl)methanone)
(2S3S3S10bR)23bis((4methoxyphenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)23bis(4methoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212264293
COC1=CC=C(C=C1)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=C(C=C7)OC
COc1ccc(cc1)C(=O)(C@H)1N2C=Cc3c((C@@H)2(C@@)2((C@@H)1C(=O)c1ccc(cc1)OC)C(=O)Nc1c2cccc1)cccc3
InChI=1SC35H28N2O5c14124151122(121624)31(38)2930(32(39)23131725(422)181423)37201921734826(21)33(37)35(29)279561028(27)3634(35)40h320293033H12H3(H3640)t293033+35+m0s1
MFCD18158389
ZINC000101671713
ZINC101671713

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Available files

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