Vitas-M small molecule compound
(3a'S,6a'R)-5-chloro-5'-(3-chloro-4-fluorophenyl)-3'-(1H-indol-3-ylmethyl)-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
STK596009
SMILES Clc1cc(C)c2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(c(c1)Cl)F)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 C29H21Cl2FN4O3 MW 563.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21Cl2FN4O3/c1-13-8-15(30)10-18-25(13)34-28(39)29(18)24-23(22(35-29)9-14-12-33-21-5-3-2-4-17(14)21)26(37)36(27(24)38)16-6-7-20(32)19(31)11-16/h2-8,10-12,22-24,33,35H,9H2,1H3,(H,34,39)/t22?,23-,24+,29?/m1/s1InChIKey
RPUKYEYTCDNLPT-WRWAZOQGSA-NSynonyms
1212486-30-0(3aR6aS)5chloro5(3chloro4fluorophenyl)1(1Hindol3ylmethyl)7methylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5chloro5(3chloro4fluorophenyl)7methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5chloro5(3chloro4fluorophenyl)3(1Hindol3ylmethyl)7methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212486300
CC1=C2C(=CC(=C1)Cl)C3(C4C(C(N3)CC5=CNC6=CC=CC=C65)C(=O)N(C4=O)C7=CC(=C(C=C7)F)Cl)C(=O)N2
Clc1cc(C)c2c(c1)C1(NC((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc(c(c1)Cl)F)Cc1c(nH)c3c1cccc3)C(=O)N2
InChI=1SC29H21Cl2FN4O3c113815(30)101825(13)3428(39)29(18)2423(22(3529)914123321532417(14)21)26(37)36(27(24)38)166720(32)19(31)1116h28101222243335H9H21H3(H3439)t22?2324+29?m1s1
MFCD18158486
ZINC000101670782
ZINC000101670792
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