Vitas-M small molecule compound

(1'R,2'R)-2'-(4-methylphenyl)-1'-[(4-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STL051426
SMILES Cc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(cc2)[N+](=O)[O-])N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

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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 C34H24N2O5 MW 540.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H24N2O5/c1-20-10-12-22(13-11-20)29-30(31(37)23-14-17-24(18-15-23)36(40)41)35-27-9-5-2-6-21(27)16-19-28(35)34(29)32(38)25-7-3-4-8-26(25)33(34)39/h2-19,28-30H,1H3/t28?,29-,30+/m0/s1
InChIKey
OANGWAPUYGARBC-YHCMTOLSSA-N
Synonyms
1216946-34-7
(1R2R)1(4nitrobenzoyl)2(ptolyl)23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)2(4methylphenyl)1((4nitrophenyl)carbonyl)12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
(1R2R)2(4methylphenyl)1(4nitrobenzoyl)spiro(23adihydro1Hpyrrolo(12a)quinoline32indene)13dione
1216946347
CC1=CC=C(C=C1)C2C(N3C(C24C(=O)C5=CC=CC=C5C4=O)C=CC6=CC=CC=C63)C(=O)C7=CC=C(C=C7)(N+)(=O)(O)
Cc1ccc(cc1)(C@H)1(C@H)(C(=O)c2ccc(cc2)(N+)(=O)(O))N2C((C@@)31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
Cc1ccc(cc1)(C@H)1(C@H)(C(=O)c2ccc(cc2)(N+)(=O)(O))N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
InChI=1SC34H24N2O5c120101222(131120)2930(31(37)23141724(181523)36(40)41)3527952621(27)161928(35)34(29)32(38)25734826(25)33(34)39h2192830H1H3t28?2930+m0s1
ZINC000100970213
ZINC000100970216

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Available files

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