Vitas-M small molecule compound

(2'S,3S,3'S,10b'R)-3'-[(2,4-dichlorophenyl)carbonyl]-2'-[(2-ethoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one

Catalog ID
STK590568
SMILES CCOc1ccccc1C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

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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 C35H26Cl2N2O4 MW 609.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H26Cl2N2O4/c1-2-43-28-14-8-5-11-24(28)31(40)29-30(32(41)23-16-15-21(36)19-26(23)37)39-18-17-20-9-3-4-10-22(20)33(39)35(29)25-12-6-7-13-27(25)38-34(35)42/h3-19,29-30,33H,2H2,1H3,(H,38,42)/t29-,30-,33+,35+/m0/s1
InChIKey
ALXHJQCNRVTVDH-CXNUKBDRSA-N
Synonyms
1212089-57-0
(1S2S3S10bR)3(24dichlorobenzoyl)2(2ethoxybenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3((24dichlorophenyl)carbonyl)2((2ethoxyphenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(24dichlorobenzoyl)2(2ethoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212089570
CCOC1=CC=CC=C1C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=C(C=C(C=C7)Cl)Cl
CCOc1ccccc1C(=O)(C@@H)1(C@@H)(C(=O)c2ccc(cc2Cl)Cl)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC35H26Cl2N2O4c12432814851124(28)31(40)2930(32(41)23161521(36)1926(23)37)391817209341022(20)33(39)35(29)2512671327(25)3834(35)42h319293033H2H21H3(H3842)t293033+35+m0s1
MFCD18158382
ZINC000101672442
ZINC101672442

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Available files

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