Vitas-M small molecule compound
(3R,3'S,3a'S,6a'R)-3'-benzyl-6-chloro-5'-(3-chloro-4-fluorophenyl)-7-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Catalog ID
STK575855
SMILES O=C1N(c2ccc(c(c2)Cl)F)C(=O)[C@@H]2[C@H]1[C@H](Cc1ccccc1)N[C@@]12C(=O)Nc2c1ccc(c2C)Cl
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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 C27H20Cl2FN3O3 MW 524.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20Cl2FN3O3/c1-13-17(28)9-8-16-23(13)31-26(36)27(16)22-21(20(32-27)11-14-5-3-2-4-6-14)24(34)33(25(22)35)15-7-10-19(30)18(29)12-15/h2-10,12,20-22,32H,11H2,1H3,(H,31,36)/t20-,21+,22-,27-/m0/s1InChIKey
IWTJTDITYRNQIE-RJESQKRESA-NSynonyms
1014091-49-6(1R3S3aS6aR)3benzyl6chloro5(3chloro4fluorophenyl)7methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(1S3R3AR6AS)1BENZYL6CHLORO5(3CHLORO4FLUOROPHENYL)7METHYLSPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)246TRIONE
(3R3S3aS6aR)3benzyl6chloro5(3chloro4fluorophenyl)7methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014091496
CC1=C(C=CC2=C1NC(=O)C23C4C(C(N3)CC5=CC=CC=C5)C(=O)N(C4=O)C6=CC(=C(C=C6)F)Cl)Cl
InChI=1SC27H20Cl2FN3O3c11317(28)981623(13)3126(36)27(16)2221(20(3227)11145324614)24(34)33(25(22)35)1571019(30)18(29)1215h21012202232H11H21H3(H3136)t2021+2227m0s1
MFCD18245539
O=C1N(c2ccc(c(c2)Cl)F)C(=O)(C@@H)2(C@H)1(C@H)(Cc1ccccc1)N(C@@)12C(=O)Nc2c1ccc(c2C)Cl
ZINC000101303726
ZINC101303726
Check stock
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Check stock on Vitas-MAvailable files
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