Vitas-M small molecule compound
(3a'S,6a'R)-5-chloro-3'-(1-hydroxyethyl)-5'-(2-methoxyethyl)-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
STK591111
SMILES COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(Cl)cc2
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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 C18H20ClN3O5 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN3O5/c1-8(23)14-12-13(16(25)22(15(12)24)5-6-27-2)18(21-14)10-7-9(19)3-4-11(10)20-17(18)26/h3-4,7-8,12-14,21,23H,5-6H2,1-2H3,(H,20,26)/t8?,12-,13-,14?,18?/m0/s1InChIKey
RNCNDEZJKDJMRW-OYYVLECBSA-NSynonyms
1214622-85-1(3aR6aS)5chloro1(1hydroxyethyl)5(2methoxyethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5chloro3(1hydroxyethyl)5(2methoxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5chloro3(1hydroxyethyl)5(2methoxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1214622851
CC(C1C2C(C(=O)N(C2=O)CCOC)C3(N1)C4=C(C=CC(=C4)Cl)NC3=O)O
COCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(Cl)cc2
InChI=1SC18H20ClN3O5c18(23)141213(16(25)22(15(12)24)56272)18(2114)1079(19)3411(10)2017(18)26h347812142123H56H212H3(H2026)t8?121314?18?m0s1
MFCD06793096
ZINC000016025023
ZINC000229898868
Check stock
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Check stock on Vitas-MAvailable files
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