Vitas-M small molecule compound

ethyl 4-{[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-a]phthalazin-6-yl)phenyl]sulfonyl}piperazine-1-carboxylate

Catalog ID
STK796219
SMILES CCOC(=O)N1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1nn2c(C)nnc2c2c1cccc2

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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 C24H26N6O4S MW 494.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O4S/c1-4-34-24(31)28-11-13-29(14-12-28)35(32,33)21-15-18(10-9-16(21)2)22-19-7-5-6-8-20(19)23-26-25-17(3)30(23)27-22/h5-10,15H,4,11-14H2,1-3H3
InChIKey
IATMEYWUXSSXIR-UHFFFAOYSA-N
Synonyms
898916-99-9
4(2METHYL5(3METHYL(124)TRIAZOLO(34A)PHTHALAZIN6YL)BENZENESULFONYL)PIPERAZINE1CARBOXYLICACIDETHYLESTER
898916999
CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C3=NN4C(=NN=C4C5=CC=CC=C53)C)C
ethyl4((2methyl5(3methyl(124)triazolo(34a)phthalazin6yl)phenyl)sulfonyl)piperazine1carboxylate
ethyl4(2methyl5(3methyl(124)triazolo(34a)phthalazin6yl)phenyl)sulfonylpiperazine1carboxylate
InChI=1SC24H26N6O4Sc143424(31)28111329(141228)35(3233)211518(10916(21)2)2219756820(19)23262517(3)30(23)2722h51015H41114H213H3
MFCD06611679
ZINC000008672455
ZINC08672455
ZINC8672455

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Available files

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