Vitas-M small molecule compound
tert-butyl 6'-amino-5-chloro-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STK751947
SMILES N#CC1=C(N)OC(=C(C21C(=O)Nc1c2cc(Cl)cc1)C(=O)OC(C)(C)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 C19H18ClN3O4 MW 387.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O4/c1-9-14(16(24)27-18(2,3)4)19(12(8-21)15(22)26-9)11-7-10(20)5-6-13(11)23-17(19)25/h5-7H,22H2,1-4H3,(H,23,25)InChIKey
VVVFSNZYSMKLIM-UHFFFAOYSA-NSynonyms
CC1=C(C2(C3=C(C=CC(=C3)Cl)NC2=O)C(=C(O1)N)C#N)C(=O)OC(C)(C)C
InChI=1SC19H18ClN3O4c1914(16(24)2718(23)4)19(12(821)15(22)269)11710(20)5613(11)2317(19)25h57H22H214H3(H2325)
MFCD00747886
TERTBUTYL(3S)6AMINO5CHLORO5CYANO2METHYL2OXO12DIHYDROSPIRO(INDOLE34PYRAN)3CARBOXYLATE
TERTBUTYL2AMINO5CHLORO3CYANO6METHYL2OXO12DIHYDROSPIRO(INDOLE34PYRAN)5CARBOXYLATE
TERTBUTYL6AMINO11CHLORO5CYANO2METHYL8OXOSPIRO(4HPYRAN43INDOLINE)3CARBOXYLATE
tertbutyl6amino5chloro5cyano2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
TERTBUTYL6AMINO5CHLORO5CYANO2METHYL2OXOSPIRO(1HINDOLE34PYRAN)3CARBOXYLATE
ZINC000001081574
ZINC000001081575
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