Vitas-M small molecule compound
(3a'S,6a'R)-5-chloro-3'-(1H-indol-3-ylmethyl)-5'-(3-methoxyphenyl)-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
STK584234
SMILES COc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2C
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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/c1-15-10-17(31)12-21-26(15)33-29(38)30(21)25-24(23(34-30)11-16-14-32-22-9-4-3-8-20(16)22)27(36)35(28(25)37)18-6-5-7-19(13-18)39-2/h3-10,12-14,23-25,32,34H,11H2,1-2H3,(H,33,38)/t23?,24-,25+,30?/m1/s1InChIKey
UICXMOJGEHYBAG-VSSSQIRHSA-NSynonyms
1014023-58-5(3aR6aS)5chloro1(1Hindol3ylmethyl)5(3methoxyphenyl)7methylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5chloro5(3methoxyphenyl)7methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5chloro3(1Hindol3ylmethyl)5(3methoxyphenyl)7methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014023585
CC1=C2C(=CC(=C1)Cl)C3(C4C(C(N3)CC5=CNC6=CC=CC=C65)C(=O)N(C4=O)C7=CC(=CC=C7)OC)C(=O)N2
COc1cccc(c1)N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2C
InChI=1SC30H25ClN4O4c1151017(31)122126(15)3329(38)30(21)2524(23(3430)1116143222943820(16)22)27(36)35(28(25)37)1865719(1318)392h310121423253234H11H212H3(H3338)t23?2425+30?m1s1
MFCD07640645
ZINC000101385755
ZINC000101385771
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