Vitas-M small molecule compound
tert-butyl 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
STK085057
SMILES N#CC1=C(N)OC2=C(C31CCN(CC3)C(=O)OC(C)(C)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 C21H29N3O4 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O4/c1-19(2,3)28-18(26)24-8-6-21(7-9-24)13(12-22)17(23)27-15-11-20(4,5)10-14(25)16(15)21/h6-11,23H2,1-5H3InChIKey
FDXIODBMEDEMGS-UHFFFAOYSA-NSynonyms
340812-20-6340812206
CC1(CC2=C(C(=O)C1)C3(CCN(CC3)C(=O)OC(C)(C)C)C(=C(O2)N)C#N)C
InChI=1SC21H29N3O4c119(23)2818(26)248621(7924)13(1222)17(23)27151120(45)1014(25)16(15)21h61123H215H3
MFCD01605335
N#CC1=C(N)OC2=C(C31CCN(CC3)C(=O)OC(C)(C)C)C(=O)CC(C2)(C)C
STK085057
tertbutyl2amino3cyano77dimethyl5oxo5678tetrahydro1Hspiro(chromene44piperidine)1carboxylate
tertbutyl2amino3cyano77dimethyl5oxo5678tetrahydrospiro(chromene44piperidine)1carboxylate
TERTBUTYL2AMINO3CYANO77DIMETHYL5OXOSPIRO(68DIHYDROCHROMENE44PIPERIDINE)1CARBOXYLATE
ZINC000002334802
ZINC02334802
ZINC2334802
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