Vitas-M small molecule compound

(1'S,3R,3'S,7a'S)-5''-chloro-1'-[(4-chlorophenyl)carbonyl]-5',6',7',7a'-tetrahydro-1'H-dispiro[indole-3,2'-pyrrolizine-3',3''-indole]-2,2''(1H,1''H)-dione

Catalog ID
STK597219
SMILES Clc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1

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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 C28H21Cl2N3O3 MW 518.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21Cl2N3O3/c29-16-9-7-15(8-10-16)24(34)23-22-6-3-13-33(22)28(19-14-17(30)11-12-21(19)32-26(28)36)27(23)18-4-1-2-5-20(18)31-25(27)35/h1-2,4-5,7-12,14,22-23H,3,6,13H2,(H,31,35)(H,32,36)/t22-,23-,27+,28+/m0/s1
InChIKey
QGAOLXFBXYSPFO-WLGONLEPSA-N
Synonyms
1014002-49-3
(1S3R3S7aS)5chloro1((4chlorophenyl)carbonyl)11225677aoctahydro1Hdispiro(indole32pyrrolizine33indole)22dione
(1S3R3S7aS)5chloro1((4chlorophenyl)carbonyl)5677atetrahydro1Hdispiro(indole32pyrrolizine33indole)22(1H1H)dione
1014002493
C1CC2C(C3(C4=CC=CC=C4NC3=O)C5(N2C1)C6=C(C=CC(=C6)Cl)NC5=O)C(=O)C7=CC=C(C=C7)Cl
Clc1ccc(cc1)C(=O)(C@@H)1(C@@H)2CCCN2(C@@)2((C@)31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(Cl)cc1
InChI=1SC28H21Cl2N3O3c29169715(81016)24(34)2322631333(22)28(191417(30)111221(19)3226(28)36)27(23)18412520(18)3125(27)35h1245712142223H3613H2(H3135)(H3236)t222327+28+m0s1
ZINC000013554634
ZINC13554634

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.