Vitas-M small molecule compound
(2-{[(2'S,3S,3'S,10b'R)-2-oxo-2'-(phenylcarbonyl)-1,2,2',3'-tetrahydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-3'-yl]carbonyl}phenoxy)acetonitrile
Catalog ID
STK584009
SMILES N#CCOc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3
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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 C35H25N3O4 MW 551.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H25N3O4/c36-19-21-42-28-17-9-6-14-25(28)32(40)30-29(31(39)23-11-2-1-3-12-23)35(26-15-7-8-16-27(26)37-34(35)41)33-24-13-5-4-10-22(24)18-20-38(30)33/h1-18,20,29-30,33H,21H2,(H,37,41)/t29-,30-,33+,35+/m0/s1InChIKey
DJWZELAZYABWQH-CXNUKBDRSA-NSynonyms
1177138-40-7(2(((2S3S3S10bR)2oxo2(phenylcarbonyl)1223tetrahydro10bHspiro(indole31pyrrolo(21a)isoquinolin)3yl)carbonyl)phenoxy)acetonitrile
1177138407
2(2((1S2S3S10bR)2benzoyl2oxo310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)3ylcarbonyl)phenoxy)acetonitrile
2(2((2S3S3S10bR)2benzoyl2oxospiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)3carbonyl)phenoxy)acetonitrile
C1=CC=C(C=C1)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=CC=C7OCC#N
InChI=1SC35H25N3O4c361921422817961425(28)32(40)3029(31(39)23112131223)35(2615781627(26)3734(35)41)332413541022(24)182038(30)33h11820293033H21H2(H3741)t293033+35+m0s1
MFCD08284465
N#CCOc1ccccc1C(=O)(C@H)1N2C=Cc3c((C@@H)2(C@@)2((C@@H)1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3
ZINC000101374886
ZINC101374886
Check stock
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Check stock on Vitas-MAvailable files
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