Vitas-M small molecule compound

3'-butyl 5'-prop-2-en-1-yl 2'-amino-6'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate

Catalog ID
STK729738
SMILES C=CCN1c2ccccc2C2(C1=O)C(=C(N)OC(=C2C(=O)OCC=C)C)C(=O)OCCCC

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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 C25H28N2O6 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O6/c1-5-8-15-32-23(29)20-21(26)33-16(4)19(22(28)31-14-7-3)25(20)17-11-9-10-12-18(17)27(13-6-2)24(25)30/h6-7,9-12H,2-3,5,8,13-15,26H2,1,4H3
InChIKey
CLZIVCXCCKILGU-UHFFFAOYSA-N
Synonyms

(S)5allyl3butyl1allyl2amino6methyl2oxospiro(indoline34pyran)35dicarboxylate
3butyl5prop2en1yl2amino6methyl2oxo1(prop2en1yl)12dihydrospiro(indole34pyran)35dicarboxylate
3OBUTYL5OPROP2ENYL2AMINO6METHYL2OXO1PROP2ENYLSPIRO(INDOLE34PYRAN)35DICARBOXYLATE
C=CCN1c2ccccc2(C@@)2(C1=O)C(=C(N)OC(=C2C(=O)OCC=C)C)C(=O)OCCCC
CCCCOC(=O)C1=C(OC(=C(C12C3=CC=CC=C3N(C2=O)CC=C)C(=O)OCC=C)C)N
InChI=1SC25H28N2O6c158153223(29)2021(26)3316(4)19(22(28)311473)25(20)17119101218(17)27(1362)24(25)30h67912H2358131526H214H3
MFCD13371786
ZINC000002370280
ZINC000009374584

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Available files

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