Vitas-M small molecule compound

methyl 2-amino-1',7,7-trimethyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate

Catalog ID
STL554106
SMILES COC(=O)C1=C(N)OC2=C(C31C(=O)N(c1c3cccc1)C)C(=O)CC(C2)(C)C

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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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c1-20(2)9-13(24)15-14(10-20)28-17(22)16(18(25)27-4)21(15)11-7-5-6-8-12(11)23(3)19(21)26/h5-8H,9-10,22H2,1-4H3
InChIKey
GNHRBXVSWFFXNG-UHFFFAOYSA-N
Synonyms
445222-71-9
3791251
445222719
InChI=1SC21H22N2O5c120(2)913(24)1514(1020)2817(22)16(18(25)274)21(15)11756812(11)23(3)19(21)26h58H91022H214H3
methyl2amino177trimethyl25dioxo125678hexahydrospiro(chromene43indole)3carboxylate
methyl2amino177trimethyl25dioxo5678tetrahydrospiro(chromene43indoline)3carboxylate
METHYL2AMINO177TRIMETHYL25DIOXOSPIRO(68DIHYDROCHROMENE43INDOLE)3CARBOXYLATE
MFCD02949220
ZINC000004029953
ZINC000004029954

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.