Vitas-M small molecule compound

(1'R,2'R)-2'-(2-ethoxyphenyl)-7'-methyl-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STK592628
SMILES CCOc1ccccc1[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C

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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 C36H29NO4 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29NO4/c1-3-41-29-16-10-9-15-27(29)31-32(33(38)23-11-5-4-6-12-23)37-28-19-17-22(2)21-24(28)18-20-30(37)36(31)34(39)25-13-7-8-14-26(25)35(36)40/h4-21,30-32H,3H2,1-2H3/t30?,31-,32+/m0/s1
InChIKey
WBIBAQMBJQRAFK-XXWVNBFBSA-N
Synonyms
1216945-37-7
(1R2R)1benzoyl2(2ethoxyphenyl)7methyl23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)1benzoyl2(2ethoxyphenyl)7methylspiro(23adihydro1Hpyrrolo(12a)quinoline32indene)13dione
(1R2R)2(2ethoxyphenyl)7methyl1(phenylcarbonyl)12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
1216945377
CCOC1=CC=CC=C1C2C(N3C(C24C(=O)C5=CC=CC=C5C4=O)C=CC6=C3C=CC(=C6)C)C(=O)C7=CC=CC=C7
CCOc1ccccc1(C@H)1(C@H)(C(=O)c2ccccc2)N2C((C@@)31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C
CCOc1ccccc1(C@H)1(C@H)(C(=O)c2ccccc2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)C
InChI=1SC36H29NO4c134129161091527(29)3132(33(38)23115461223)3728191722(2)2124(28)182030(37)36(31)34(39)2513781426(25)35(36)40h4213032H3H212H3t30?3132+m0s1
ZINC000101275206
ZINC000101275208

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Available files

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