Vitas-M small molecule compound
(1'S,2'S,3R,3a'R)-2'-[(4-fluorophenyl)carbonyl]-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STK611805
SMILES Fc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1
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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 C31H21FN2O3S MW 520.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21FN2O3S/c32-20-14-11-19(12-15-20)28(35)26-27(29(36)24-10-5-17-38-24)34-23-9-4-1-6-18(23)13-16-25(34)31(26)21-7-2-3-8-22(21)33-30(31)37/h1-17,25-27H,(H,33,37)/t25-,26+,27+,31-/m1/s1InChIKey
JXIFGIKSJABQSW-ANOKCIKSSA-NSynonyms
1177744-36-3(1S2S3R3aR)2((4fluorophenyl)carbonyl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)2(4fluorobenzoyl)1(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
(1S2S3R3aR)2(4fluorobenzoyl)1(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
1177744363
C1=CC=C2C(=C1)C=CC3N2C(C(C34C5=CC=CC=C5NC4=O)C(=O)C6=CC=C(C=C6)F)C(=O)C7=CC=CS7
Fc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2cccs2)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1
InChI=1SC31H21FN2O3Sc3220141119(121520)28(35)2627(29(36)24105173824)3423941618(23)131625(34)31(26)21723822(21)3330(31)37h1172527H(H3337)t2526+27+31m1s1
MFCD18246271
ZINC000097954877
ZINC97954877
Check stock
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Check stock on Vitas-MAvailable files
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