Vitas-M small molecule compound
(2'S,3S,3'S)-N-(4-chlorophenyl)-2'-[(4-methoxyphenyl)carbonyl]-2-oxo-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinoline]-3'-carboxamide
Catalog ID
STK544552
SMILES COc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)Nc2ccc(cc2)Cl)N2C([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 C34H26ClN3O4 MW 576.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26ClN3O4/c1-42-24-16-10-21(11-17-24)30(39)28-29(32(40)36-23-14-12-22(35)13-15-23)38-19-18-20-6-2-3-7-25(20)31(38)34(28)26-8-4-5-9-27(26)37-33(34)41/h2-19,28-29,31H,1H3,(H,36,40)(H,37,41)/t28-,29-,31?,34+/m0/s1InChIKey
BNKSMNUMXUZSKY-REUDUKOLSA-NSynonyms
(2S3S3S)N(4chlorophenyl)2((4methoxyphenyl)carbonyl)2oxo1223tetrahydro10bHspiro(indole31pyrrolo(21a)isoquinoline)3carboxamide
(2S3S3S)N(4chlorophenyl)2(4methoxybenzoyl)2oxospiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)3carboxamide
COC1=CC=C(C=C1)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)NC7=CC=C(C=C7)Cl
COc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)Nc2ccc(cc2)Cl)N2C((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC34H26ClN3O4c14224161021(111724)30(39)2829(32(40)3623141222(35)131523)38191820623725(20)31(38)34(28)26845927(26)3733(34)41h219282931H1H3(H3640)(H3741)t282931?34+m0s1
MFCD18242159
ZINC000102438690
ZINC000102438695
Check stock
See real-time availability and sample size for STK544552 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.