Vitas-M small molecule compound

N-(2-hydroxyethyl)-4-methoxy-N-methyl-3-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide

Catalog ID
STL263317
SMILES OCCN(S(=O)(=O)c1ccc(c(c1)c1nnc2n1nc(C)c1c2cccc1)OC)C

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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 C20H21N5O4S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4S/c1-13-15-6-4-5-7-16(15)19-21-22-20(25(19)23-13)17-12-14(8-9-18(17)29-3)30(27,28)24(2)10-11-26/h4-9,12,26H,10-11H2,1-3H3
InChIKey
RKHSOIYWKCMPHF-UHFFFAOYSA-N
Synonyms
861139-16-4
861139164
CC1=NN2C(=NN=C2C3=C(C=CC(=C3)S(=O)(=O)N(C)CCO)OC)C4=CC=CC=C14
InChI=1SC20H21N5O4Sc11315645716(15)19212220(25(19)2313)171214(8918(17)293)30(2728)24(2)101126h491226H1011H213H3
MFCD05683760
N(2hydroxyethyl)4methoxyNmethyl3(6methyl(124)triazolo(34a)phthalazin3yl)benzenesulfonamide
ZINC000003655647
ZINC03655647
ZINC3655647

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Available files

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