Vitas-M small molecule compound
methyl 6'-amino-1-[2-(benzyloxy)-2-oxoethyl]-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STL016018
SMILES COC(=O)C1=C(C)OC(=C(C21C(=O)N(c1c2cccc1)CC(=O)OCc1ccccc1)C#N)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 C25H21N3O6 MW 459.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O6/c1-15-21(23(30)32-2)25(18(12-26)22(27)34-15)17-10-6-7-11-19(17)28(24(25)31)13-20(29)33-14-16-8-4-3-5-9-16/h3-11H,13-14,27H2,1-2H3InChIKey
HFNNTQNXKHKEAI-UHFFFAOYSA-NSynonyms
(R)methyl2amino1(2(benzyloxy)2oxoethyl)3cyano6methyl2oxospiro(indoline34pyran)5carboxylate
CC1=C(C2(C3=CC=CC=C3N(C2=O)CC(=O)OCC4=CC=CC=C4)C(=C(O1)N)C#N)C(=O)OC
COC(=O)C1=C(C)OC(=C((C@)21C(=O)N(c1c2cccc1)CC(=O)OCc1ccccc1)C#N)N
InChI=1SC25H21N3O6c11521(23(30)322)25(18(1226)22(27)3415)1710671119(17)28(24(25)31)1320(29)3314168435916h311H131427H212H3
methyl6amino1(2(benzyloxy)2oxoethyl)5cyano2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
METHYL6AMINO5CYANO2METHYL2OXO1(2OXO2PHENYLMETHOXYETHYL)SPIRO(INDOLE34PYRAN)3CARBOXYLATE
MFCD18186915
ZINC000009014325
ZINC000009695323
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