Vitas-M small molecule compound
methyl 6'-amino-6-bromo-5'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STK956911
SMILES COC(=O)C1=C(C)OC(=C(C21C(=O)Nc1c2ccc(c1)Br)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 C16H12BrN3O4 MW 390.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrN3O4/c1-7-12(14(21)23-2)16(10(6-18)13(19)24-7)9-4-3-8(17)5-11(9)20-15(16)22/h3-5H,19H2,1-2H3,(H,20,22)InChIKey
QSDQCLABIZGMEI-UHFFFAOYSA-NSynonyms
353469-16-6353469166
6AMINO6BROMO5CYANO13DIHYDRO3METHOXYCARBONYL2METHYL2OXOSPIRO(4HPYRAN43(2H)INDOLE)
CC1=C(C2(C3=C(C=C(C=C3)Br)NC2=O)C(=C(O1)N)C#N)C(=O)OC
InChI=1SC16H12BrN3O4c1712(14(21)232)16(10(618)13(19)247)9438(17)511(9)2015(16)22h35H19H212H3(H2022)
METHYL(3R)6AMINO6BROMO5CYANO2METHYL2OXO12DIHYDROSPIRO(INDOLE34PYRAN)3CARBOXYLATE
METHYL(3S)6AMINO6BROMO5CYANO2METHYL2OXO12DIHYDROSPIRO(INDOLE34PYRAN)3CARBOXYLATE
METHYL2AMINO6BROMO3CYANO6METHYL2OXO12DIHYDROSPIRO(INDOLE34PYRAN)5CARBOXYLATE
methyl6amino6bromo5cyano2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
METHYL6AMINO6BROMO5CYANO2METHYL2OXOSPIRO(1HINDOLE34PYRAN)3CARBOXYLATE
MFCD01451685
ZINC000000994174
ZINC000000994175
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