Vitas-M small molecule compound

N-[2-methyl-5-(3-propyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl]benzenesulfonamide

Catalog ID
STK796565
SMILES CCCc1nnc2n1nc(c1ccc(c(c1)NS(=O)(=O)c1ccccc1)C)c1c2cccc1

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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 C25H23N5O2S MW 457.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O2S/c1-3-9-23-26-27-25-21-13-8-7-12-20(21)24(28-30(23)25)18-15-14-17(2)22(16-18)29-33(31,32)19-10-5-4-6-11-19/h4-8,10-16,29H,3,9H2,1-2H3
InChIKey
XCWSBIXSOKQRRY-UHFFFAOYSA-N
Synonyms
900888-65-5
900888655
CCCC1=NN=C2N1N=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)NS(=O)(=O)C5=CC=CC=C5
InChI=1SC25H23N5O2Sc139232627252113871220(21)24(2830(23)25)18151417(2)22(1618)2933(3132)19105461119h48101629H39H212H3
MFCD06779290
N(2methyl5(3propyl(124)triazolo(34a)phthalazin6yl)phenyl)benzenesulfonamide
ZINC000009488348
ZINC09488348
ZINC9488348

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.