Vitas-M small molecule compound
5',7'-dimethyl-2'-{[4-(2-methylpropyl)phenyl]carbonyl}-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL529199
SMILES CC(Cc1ccc(cc1)C(=O)C1C(C(=O)c2ccccc2)N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2ccc(c1)C)C)C
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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 C39H36N2O3 MW 580.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H36N2O3/c1-23(2)20-26-15-17-28(18-16-26)36(42)34-35(37(43)27-10-6-5-7-11-27)41-32-19-14-24(3)21-29(32)25(4)22-33(41)39(34)30-12-8-9-13-31(30)40-38(39)44/h5-19,21-23,33-35H,20H2,1-4H3,(H,40,44)InChIKey
YVZIQDUSNTVFNS-UHFFFAOYSA-NSynonyms
(1S2S3R3aR)1benzoyl2(4isobutylbenzoyl)57dimethyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1benzoyl57dimethyl2(4(2methylpropyl)benzoyl)spiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)2one
3796540
57dimethyl2((4(2methylpropyl)phenyl)carbonyl)1(phenylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
CC(Cc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccccc2)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=C(c1c2ccc(c1)C)C)C
InChI=1SC39H36N2O3c123(2)2026151728(181626)36(42)3435(37(43)27106571127)4132191424(3)2129(32)25(4)2233(41)39(34)3012891331(30)4038(39)44h51921233335H20H214H3(H4044)
MFCD05726070
ZINC000102191149
ZINC000248204232
Check stock
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Check stock on Vitas-MAvailable files
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