Vitas-M small molecule compound

ethyl 2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-1'H-spiro[chromene-4,4'-piperidine]-1'-carboxylate

Catalog ID
STK075390
SMILES CCOC(=O)N1CCC2(CC1)C(=C(N)OC1=C2C(=O)CC(C1)(C)C)C#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 C19H25N3O4 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O4/c1-4-25-17(24)22-7-5-19(6-8-22)12(11-20)16(21)26-14-10-18(2,3)9-13(23)15(14)19/h4-10,21H2,1-3H3
InChIKey
IDUCBGVUBKESCZ-UHFFFAOYSA-N
Synonyms
340812-17-1
340812171
CCOC(=O)N1CCC2(CC1)C(=C(N)OC1=C2C(=O)CC(C1)(C)C)C#N
CCOC(=O)N1CCC2(CC1)C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N
ethyl2amino3cyano77dimethyl5oxo5678tetrahydro1Hspiro(chromene44piperidine)1carboxylate
ethyl2amino3cyano77dimethyl5oxo5678tetrahydrospiro(chromene44piperidine)1carboxylate
ETHYL2AMINO3CYANO77DIMETHYL5OXOSPIRO(4H678TRIHYDROCHROMENE44PIPERIDINE)11CARBOXYLATE
ETHYL2AMINO3CYANO77DIMETHYL5OXOSPIRO(68DIHYDROCHROMENE44PIPERIDINE)1CARBOXYLATE
InChI=1SC19H25N3O4c142517(24)227519(6822)12(1120)16(21)26141018(23)913(23)15(14)19h41021H213H3
MFCD01605332
STK075390
ZINC000000808855
ZINC00808855
ZINC808855

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Available files

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