Vitas-M small molecule compound

N-methyl-2-[4-({4-[4-methyl-3-(methylsulfamoyl)phenyl]phthalazin-1-yl}amino)phenoxy]acetamide

Catalog ID
STK062449
SMILES CNC(=O)COc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NC)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 C25H25N5O4S MW 491.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O4S/c1-16-8-9-17(14-22(16)35(32,33)27-3)24-20-6-4-5-7-21(20)25(30-29-24)28-18-10-12-19(13-11-18)34-15-23(31)26-2/h4-14,27H,15H2,1-3H3,(H,26,31)(H,28,30)
InChIKey
LSILBJYOYIPWHN-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OCC(=O)NC)S(=O)(=O)NC
CNC(=O)COc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NC)C
InChI=1SC25H25N5O4Sc1168917(1422(16)35(3233)273)2420645721(20)25(302924)2818101219(131118)341523(31)262h41427H15H213H3(H2631)(H2830)
MFCD02240571
NMETHYL2(4(((1E)4(4METHYL3(METHYLSULFAMOYL)PHENYL)PHTHALAZIN1(2H)YLIDENE)AMINO)PHENOXY)ACETAMIDE
NMETHYL2(4((4(4METHYL3(METHYLSULFAMOYL)PHENYL)PHTHALAZIN1YL)AMINO)PHENOXY)ACETAMIDE
Nmethyl2(4((4(4methyl3(Nmethylsulfamoyl)phenyl)phthalazin1yl)amino)phenoxy)acetamide
STK062449
ZINC18116346

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Available files

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