Vitas-M small molecule compound
6'-amino-6-bromo-3',5-dimethyl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Catalog ID
STK032763
SMILES N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(C)c(c1)Br)c(C)n[nH]2
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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 C16H12BrN5O2 MW 386.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrN5O2/c1-6-3-8-11(4-10(6)17)20-15(23)16(8)9(5-18)13(19)24-14-12(16)7(2)21-22-14/h3-4H,19H2,1-2H3,(H,20,23)(H,21,22)InChIKey
XWVJDGPFIDMSNC-UHFFFAOYSA-NSynonyms
6AMINO6BROMO35DIMETHYL2OXO12DIHYDRO1HSPIRO(INDOLE34PYRANO(23C)PYRAZOLE)5CARBONITRILE
6AMINO6BROMO35DIMETHYL2OXOSPIRO(1HINDOLE342HPYRANO(23C)PYRAZOLE)5CARBONITRILE
CC1=C(C=C2C(=C1)C3(C(=C(OC4=NNC(=C43)C)N)C#N)C(=O)N2)Br
InChI=1SC16H12BrN5O2c163811(410(6)17)2015(23)16(8)9(518)13(19)241412(16)7(2)212214h34H19H212H3(H2023)(H2122)
MFCD02073342
N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(C)c(c1)Br)c(C)n(nH)2
STK032763
ZINC000000943757
ZINC000000943758
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