Vitas-M small molecule compound
methyl 6'-amino-1-(2-amino-2-oxoethyl)-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STL015985
SMILES COC(=O)C1=C(C)OC(=C(C21c1ccccc1N(C2=O)CC(=O)N)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 C18H16N4O5 MW 368.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N4O5/c1-9-14(16(24)26-2)18(11(7-19)15(21)27-9)10-5-3-4-6-12(10)22(17(18)25)8-13(20)23/h3-6H,8,21H2,1-2H3,(H2,20,23)InChIKey
XEDQTLKEYNDKJF-UHFFFAOYSA-NSynonyms
(R)methyl2amino1(2amino2oxoethyl)3cyano6methyl2oxospiro(indoline34pyran)5carboxylate
CC1=C(C2(C3=CC=CC=C3N(C2=O)CC(=O)N)C(=C(O1)N)C#N)C(=O)OC
COC(=O)C1=C(C)OC(=C((C@@)21c1ccccc1N(C2=O)CC(=O)N)C#N)N
InChI=1SC18H16N4O5c1914(16(24)262)18(11(719)15(21)279)10534612(10)22(17(18)25)813(20)23h36H821H212H3(H22023)
methyl6amino1(2amino2oxoethyl)5cyano2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
METHYL6AMINO1(2AMINO2OXOETHYL)5CYANO2METHYL2OXOSPIRO(INDOLE34PYRAN)3CARBOXYLATE
MFCD14710653
ZINC000002222177
ZINC000002497109
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