Vitas-M small molecule compound

(1'R,2'R)-7'-chloro-2'-(pyridin-3-yl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STK589285
SMILES Clc1ccc2c(c1)C=CC1N2[C@@H](C(=O)c2cccs2)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1cccnc1

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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 C30H19ClN2O3S MW 523.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H19ClN2O3S/c31-19-10-11-22-17(15-19)9-12-24-30(28(35)20-6-1-2-7-21(20)29(30)36)25(18-5-3-13-32-16-18)26(33(22)24)27(34)23-8-4-14-37-23/h1-16,24-26H/t24?,25-,26+/m0/s1
InChIKey
XQPITUQBPIBYFD-XBCLTQTASA-N
Synonyms
1216947-80-6
(1R2R)7chloro2(pyridin3yl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)7chloro2(pyridin3yl)1(thiophene2carbonyl)23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)7chloro2pyridin3yl1(thiophene2carbonyl)spiro(23adihydro1Hpyrrolo(12a)quinoline32indene)13dione
1216947806
C1=CC=C2C(=C1)C(=O)C3(C2=O)C4C=CC5=C(N4C(C3C6=CN=CC=C6)C(=O)C7=CC=CS7)C=CC(=C5)Cl
Clc1ccc2c(c1)C=CC1N2(C@@H)(C(=O)c2cccs2)(C@@H)((C@@)21C(=O)c1c(C2=O)cccc1)c1cccnc1
Clc1ccc2c(c1)C=CC1N2(C@@H)(C(=O)c2cccs2)(C@@H)(C21C(=O)c1c(C2=O)cccc1)c1cccnc1
InChI=1SC30H19ClN2O3Sc311910112217(1519)9122430(28(35)20612721(20)29(30)36)25(185313321618)26(33(22)24)27(34)2384143723h1162426Ht24?2526+m0s1
ZINC000101258387
ZINC000101258390

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Available files

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