Vitas-M small molecule compound

2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(2-methyl-1-pentanoyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylacetamide

Catalog ID
STK074478
SMILES CCCCC(=O)N1C(C)CC(c2c1cccc2)N(C(=O)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)c1ccccc1

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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 C35H33N3O4 MW 559.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33N3O4/c1-3-4-20-31(39)37-23(2)21-30(26-16-8-9-19-29(26)37)38(25-14-6-5-7-15-25)32(40)22-36-34(41)27-17-10-12-24-13-11-18-28(33(24)27)35(36)42/h5-19,23,30H,3-4,20-22H2,1-2H3
InChIKey
XNHRTDLVBWIPQS-UHFFFAOYSA-N
Synonyms

2(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)N(2methyl1pentanoyl1234tetrahydroquinolin4yl)Nphenylacetamide
2(13DIOXOBENZO(DE)ISOQUINOLIN2YL)N(2METHYL1PENTANOYL34DIHYDRO2HQUINOLIN4YL)NPHENYLACETAMIDE
CCCCC(=O)N1C(C)CC(c2c1cccc2)N(C(=O)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)c1ccccc1
CCCCC(=O)N1C(CC(C2=CC=CC=C21)N(C3=CC=CC=C3)C(=O)CN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O)C
InChI=1SC35H33N3O4c1342031(39)3723(2)2130(2616891929(26)37)38(25146571525)32(40)223634(41)271710122413111828(33(24)27)35(36)42h5192330H342022H212H3
MFCD01171488
STK074478
ZINC000098045083
ZINC000098045086

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Available files

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