Vitas-M small molecule compound

(1'R,2'R,3a'R)-2'-(4-methoxyphenyl)-1'-(phenylcarbonyl)-1',2'-dihydrospiro[indene-2,3'-pyrrolo[2,1-b][1,3]benzothiazole]-1,3-dione

Catalog ID
STL527708
SMILES COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2[C@@H]([C@@]31C(=O)c1c(C3=O)cccc1)Sc1c2cccc1

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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 C32H23NO4S MW 517.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23NO4S/c1-37-21-17-15-19(16-18-21)26-27(28(34)20-9-3-2-4-10-20)33-24-13-7-8-14-25(24)38-31(33)32(26)29(35)22-11-5-6-12-23(22)30(32)36/h2-18,26-27,31H,1H3/t26-,27+,31+/m0/s1
InChIKey
HVQFYVSVNPLREU-SWFBWHSRSA-N
Synonyms
1177981-83-7
(1~(R)2~(R)3~(a)~(R))1benzoyl2(4methoxyphenyl)spiro(23~(a)dihydro1~(H)pyrrolo(21b)(13)benzothiazole32indene)13dione
(1R2R3aR)1benzoyl2(4methoxyphenyl)23adihydro1Hspiro(benzo(d)pyrrolo(21b)thiazole32indene)13dione
(1R2R3aR)2(4methoxyphenyl)1(phenylcarbonyl)12dihydrospiro(indene23pyrrolo(21b)(13)benzothiazole)13dione
1177981837
16398250
COc1ccc(cc1)(C@H)1(C@H)(C(=O)c2ccccc2)N2(C@@H)(C31C(=O)c1c(C3=O)cccc1)Sc1c2cccc1
InChI=1SC32H23NO4Sc13721171519(161821)2627(28(34)2093241020)332413781425(24)3831(33)32(26)29(35)2211561223(22)30(32)36h218262731H1H3t2627+31+m0s1
MFCD03661279
ZINC000033934954
ZINC33934954

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Available files

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