Vitas-M small molecule compound
(1'R,2'S,3R)-1'-acetyl-7'-methoxy-2'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STK543938
SMILES COc1ccc2c(c1)C=CC1N2[C@@H](C(=O)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccs1
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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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-15(30)24-23(25(31)21-8-5-13-34-21)27(18-6-3-4-7-19(18)28-26(27)32)22-12-9-16-14-17(33-2)10-11-20(16)29(22)24/h3-14,22-24H,1-2H3,(H,28,32)/t22?,23-,24-,27+/m0/s1InChIKey
BRUAMEXMFBBSCU-IRZBCVNTSA-NSynonyms
1212460-27-9(1R2S3R)1acetyl7methoxy2(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1R2S3R)1acetyl7methoxy2(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
(1R2S3R)1acetyl7methoxy2(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
1212460279
CC(=O)C1C(C2(C3N1C4=C(C=C3)C=C(C=C4)OC)C5=CC=CC=C5NC2=O)C(=O)C6=CC=CS6
COc1ccc2c(c1)C=CC1N2(C@@H)(C(=O)C)(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1cccs1
InChI=1SC27H22N2O4Sc115(30)2423(25(31)2185133421)27(18634719(18)2826(27)32)22129161417(332)101120(16)29(22)24h3142224H12H3(H2832)t22?232427+m0s1
MFCD18242115
ZINC000009273106
ZINC000009273107
Check stock
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Check stock on Vitas-MAvailable files
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