Vitas-M small molecule compound

ethyl (4-amino-3-cyano-2'-oxo-6,7-dihydrospiro[1,3-dioxolo[4,5-g]pyrido[2,1-a]isoquinoline-2,3'-indol]-1'(2'H)-yl)acetate

Catalog ID
STK608144
SMILES CCOC(=O)CN1c2ccccc2C2(C1=O)C=C1N(C(=C2C#N)N)CCc2c1cc1OCOc1c2

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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 C26H22N4O5 MW 470.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O5/c1-2-33-23(31)13-30-19-6-4-3-5-17(19)26(25(30)32)11-20-16-10-22-21(34-14-35-22)9-15(16)7-8-29(20)24(28)18(26)12-27/h3-6,9-11H,2,7-8,13-14,28H2,1H3
InChIKey
NYEZLXDTNYTOJV-UHFFFAOYSA-N
Synonyms
883961-26-0
883961260
CCOC(=O)CN1C2=CC=CC=C2C3(C1=O)C=C4C5=CC6=C(C=C5CCN4C(=C3C#N)N)OCO6
ethyl(4amino3cyano2oxo67dihydrospiro(13dioxolo(45g)pyrido(21a)isoquinoline23indol)1(2H)yl)acetate
ethyl2(4amino3cyano2oxo67dihydrospiro((13)dioxolo(45g)pyrido(21a)isoquinoline23indolin)1yl)acetate
ethyl2(4amino3cyano2oxospiro(67dihydro(13)benzodioxolo(65a)quinolizine23indole)1yl)acetate
InChI=1SC26H22N4O5c123323(31)133019643517(19)26(25(30)32)112016102221(34143522)915(16)7829(20)24(28)18(26)1227h36911H278131428H21H3
MFCD07641812
ZINC000009130058
ZINC000009130059

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Available files

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