Vitas-M small molecule compound

3'-benzyl 5'-ethyl 2'-amino-6'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate

Catalog ID
STK790916
SMILES CCOC(=O)C1=C(C)OC(=C(C21C(=O)Nc1c2cccc1)C(=O)OCc1ccccc1)N

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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 C24H22N2O6 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O6/c1-3-30-21(27)18-14(2)32-20(25)19(22(28)31-13-15-9-5-4-6-10-15)24(18)16-11-7-8-12-17(16)26-23(24)29/h4-12H,3,13,25H2,1-2H3,(H,26,29)
InChIKey
TWYBNKKRQHKNIK-UHFFFAOYSA-N
Synonyms

(S)3benzyl5ethyl2amino6methyl2oxospiro(indoline34pyran)35dicarboxylate
3BENZYL5ETHYL2AMINO6METHYL13DIHYDRO2OXOSPIRO(2HINDOLE34(4H)PYRAN)35DICARBOXYLATE
3benzyl5ethyl2amino6methyl2oxo12dihydrospiro(indole34pyran)35dicarboxylate
3OBENZYL5OETHYL2AMINO6METHYL2OXOSPIRO(1HINDOLE34PYRAN)35DICARBOXYLATE
CCOC(=O)C1=C(C)OC(=C((C@)21C(=O)Nc1c2cccc1)C(=O)OCc1ccccc1)N
CCOC(=O)C1=C(OC(=C(C12C3=CC=CC=C3NC2=O)C(=O)OCC4=CC=CC=C4)N)C
InChI=1SC24H22N2O6c133021(27)1814(2)3220(25)19(22(28)31131595461015)24(18)1611781217(16)2623(24)29h412H31325H212H3(H2629)
MFCD00827073
ZINC000000714548
ZINC000000714549

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Available files

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