Vitas-M small molecule compound
(3a'S,6a'R)-5'-(1,3-benzodioxol-5-yl)-7-chloro-3'-(1H-indol-3-ylmethyl)-5-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
STK602709
SMILES Cc1cc(Cl)c2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCO3)Cc1c[nH]c3c1cccc3)C(=O)N2
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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 C30H23ClN4O5 MW 554.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23ClN4O5/c1-14-8-18-26(19(31)9-14)33-29(38)30(18)25-24(21(34-30)10-15-12-32-20-5-3-2-4-17(15)20)27(36)35(28(25)37)16-6-7-22-23(11-16)40-13-39-22/h2-9,11-12,21,24-25,32,34H,10,13H2,1H3,(H,33,38)/t21?,24-,25+,30?/m1/s1InChIKey
FBFPEQPRFBWRQE-HYEJMQACSA-NSynonyms
1212437-91-6(3aR6aS)5(13benzodioxol5yl)7chloro1(1Hindol3ylmethyl)5methylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5(benzo(d)(13)dioxol5yl)7chloro5methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5(13benzodioxol5yl)7chloro3(1Hindol3ylmethyl)5methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212437916
CC1=CC(=C2C(=C1)C3(C4C(C(N3)CC5=CNC6=CC=CC=C65)C(=O)N(C4=O)C7=CC8=C(C=C7)OCO8)C(=O)N2)Cl
Cc1cc(Cl)c2c(c1)C1(NC((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc3c(c1)OCO3)Cc1c(nH)c3c1cccc3)C(=O)N2
InChI=1SC30H23ClN4O5c11481826(19(31)914)3329(38)30(18)2524(21(3430)1015123220532417(15)20)27(36)35(28(25)37)16672223(1116)40133922h2911122124253234H1013H21H3(H3338)t21?2425+30?m1s1
MFCD14236587
ZINC000101546184
ZINC000101546202
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