Vitas-M small molecule compound
(3a'S,6a'R)-5'-tert-butyl-7-chloro-3'-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
STK585076
SMILES CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1Cl
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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 C18H20ClN3O3 MW 361.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3O3/c1-8-11-12(15(24)22(14(11)23)17(2,3)4)18(21-8)9-6-5-7-10(19)13(9)20-16(18)25/h5-8,11-12,21H,1-4H3,(H,20,25)/t8?,11-,12+,18?/m1/s1InChIKey
KXSALVHRLVXAQD-KHFJVYEZSA-NSynonyms
1214632-55-9(3aR6aS)5tertbutyl7chloro1methylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(tertbutyl)7chloro3methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5tertbutyl7chloro3methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1214632559
CC1C2C(C(=O)N(C2=O)C(C)(C)C)C3(N1)C4=C(C(=CC=C4)Cl)NC3=O
CC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1Cl
InChI=1SC18H20ClN3O3c181112(15(24)22(14(11)23)17(23)4)18(218)965710(19)13(9)2016(18)25h58111221H14H3(H2025)t8?1112+18?m1s1
MFCD06792390
ZINC000016024925
ZINC000016024930
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