Vitas-M small molecule compound

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

Catalog ID
STL527621
SMILES COc1ccc(cc1Br)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)Br)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 C34H24Br2N2O4 MW 684.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H24Br2N2O4/c1-42-27-15-12-21(18-25(27)36)31(40)29-28(30(39)20-10-13-22(35)14-11-20)34(24-8-4-5-9-26(24)37-33(34)41)32-23-7-3-2-6-19(23)16-17-38(29)32/h2-18,28-29,32H,1H3,(H,37,41)/t28-,29-,32+,34+/m0/s1
InChIKey
HSADSDYULVQLDN-GGKJBDKJSA-N
Synonyms
1177706-83-0
(1S2S3S10bR)3(3bromo4methoxybenzoyl)2(4bromobenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2~(S)3~(S)3~(S)10~(b)~(R))2(4bromobenzoyl)3(3bromo4methoxybenzoyl)spiro(1~(H)indole31310~(b)dihydro2~(H)pyrrolo(21a)isoquinoline)2one
(2S3S3S10bR)3((3bromo4methoxyphenyl)carbonyl)2((4bromophenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
1177706830
16398100
COc1ccc(cc1Br)C(=O)(C@H)1N2C=Cc3c((C@@H)2(C@@)2((C@@H)1C(=O)c1ccc(cc1)Br)C(=O)Nc1c2cccc1)cccc3
InChI=1SC34H24Br2N2O4c14227151221(1825(27)36)31(40)2928(30(39)20101322(35)141120)34(24845926(24)3733(34)41)3223732619(23)161738(29)32h218282932H1H3(H3741)t282932+34+m0s1
MFCD03660393
ZINC000079210135
ZINC79210135

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Available files

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