Vitas-M small molecule compound

8-bromo-3-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STL301040
SMILES CCCCc1c(C)nn(c1C)c1nnc2c(n1)[nH]c1c2cc(cc1)Br

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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 C18H19BrN6 MW 399.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrN6/c1-4-5-6-13-10(2)24-25(11(13)3)18-21-17-16(22-23-18)14-9-12(19)7-8-15(14)20-17/h7-9H,4-6H2,1-3H3,(H,20,21,23)
InChIKey
WKZCAOSPXXEESK-UHFFFAOYSA-N
Synonyms
311813-85-1
311813851
8bromo3(4butyl35dimethyl1Hpyrazol1yl)5H(124)triazino(56b)indole
8BROMO3(4BUTYL35DIMETHYLPYRAZOL1YL)5H(124)TRIAZINO(56B)INDOLE
CCCCC1=C(N(N=C1C)C2=NC3=C(C4=C(N3)C=CC(=C4)Br)N=N2)C
CCCCc1c(C)nn(c1C)c1nnc2c(n1)(nH)c1c2cc(cc1)Br
InChI=1SC18H19BrN6c14561310(2)2425(11(13)3)18211716(222318)14912(19)7815(14)2017h79H46H213H3(H202123)
MFCD00640488
ZINC000003027537
ZINC03027537
ZINC3027537

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Available files

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