Vitas-M small molecule compound
(3a'S,6a'R)-5-chloro-3'-(1H-indol-3-ylmethyl)-5'-(2-methoxybenzyl)-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
STL533303
SMILES COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)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 C30H25ClN4O4 MW 541.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClN4O4/c1-39-24-9-5-2-6-16(24)15-35-27(36)25-23(12-17-14-32-21-8-4-3-7-19(17)21)34-30(26(25)28(35)37)20-13-18(31)10-11-22(20)33-29(30)38/h2-11,13-14,23,25-26,32,34H,12,15H2,1H3,(H,33,38)/t23?,25-,26+,30?/m1/s1InChIKey
JJKATDSZJFBADD-DXLHRVRJSA-NSynonyms
956812-88-7(3~(a)~(R)6~(a)~(S))5chloro1(1~(H)indol3ylmethyl)5((2methoxyphenyl)methyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5chloro5(2methoxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5chloro3(1Hindol3ylmethyl)5(2methoxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16402554
956812887
COc1ccccc1CN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2
InChI=1SC30H25ClN4O4c13924952616(24)153527(36)2523(1217143221843719(17)21)3430(26(25)28(35)37)201318(31)101122(20)3329(30)38h21113142325263234H1215H21H3(H3338)t23?2526+30?m1s1
MFCD06493908
ZINC000070692318
ZINC000070692321
Check stock
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Check stock on Vitas-MAvailable files
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