Vitas-M small molecule compound
methyl 6'-amino-1-(2-amino-2-oxoethyl)-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STL015986
SMILES COC(=O)C1=C(CC(=O)OC)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 C20H18N4O7 MW 426.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O7/c1-29-15(26)7-13-16(18(27)30-2)20(11(8-21)17(23)31-13)10-5-3-4-6-12(10)24(19(20)28)9-14(22)25/h3-6H,7,9,23H2,1-2H3,(H2,22,25)InChIKey
MGGQEIMYEAACOW-UHFFFAOYSA-NSynonyms
(R)methyl2amino1(2amino2oxoethyl)3cyano6(2methoxy2oxoethyl)2oxospiro(indoline34pyran)5carboxylate
COC(=O)C1=C(CC(=O)OC)OC(=C((C@@)21c1ccccc1N(C2=O)CC(=O)N)C#N)N
COC(=O)CC1=C(C2(C3=CC=CC=C3N(C2=O)CC(=O)N)C(=C(O1)N)C#N)C(=O)OC
InChI=1SC20H18N4O7c12915(26)71316(18(27)302)20(11(821)17(23)3113)10534612(10)24(19(20)28)914(22)25h36H7923H212H3(H22225)
methyl6amino1(2amino2oxoethyl)5cyano2(2methoxy2oxoethyl)2oxo12dihydrospiro(indole34pyran)3carboxylate
METHYL6AMINO1(2AMINO2OXOETHYL)5CYANO2(2METHOXY2OXOETHYL)2OXOSPIRO(INDOLE34PYRAN)3CARBOXYLATE
MFCD18186908
ZINC000002224850
ZINC000009329447
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