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Vitas-M small molecule compound

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

Catalog ID
STK068657
SMILES CNC(=O)COc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCC1CCCO1)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 C29H31N5O5S MW 561.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O5S/c1-19-9-10-20(16-26(19)40(36,37)31-17-23-6-5-15-38-23)28-24-7-3-4-8-25(24)29(34-33-28)32-21-11-13-22(14-12-21)39-18-27(35)30-2/h3-4,7-14,16,23,31H,5-6,15,17-18H2,1-2H3,(H,30,35)(H,32,34)
InChIKey
WIBDBSPUEFGQNS-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)NCC5CCCO5
CNC(=O)COc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NCC1CCCO1)C
InChI=1SC29H31N5O5Sc11991020(1626(19)40(3637)31172365153823)2824734825(24)29(343328)3221111322(141221)391827(35)302h34714162331H56151718H212H3(H3035)(H3234)
MFCD03289166
NMETHYL2(4(((1Z)4(4METHYL3((TETRAHYDROFURAN2YLMETHYL)SULFAMOYL)PHENYL)PHTHALAZIN1(2H)YLIDENE)AMINO)PHENOXY)ACETAMIDE
NMETHYL2(4((4(4METHYL3((TETRAHYDROFURAN2YLMETHYL)SULFAMOYL)PHENYL)PHTHALAZIN1YL)AMINO)PHENOXY)ACETAMIDE
Nmethyl2(4((4(4methyl3(N((tetrahydrofuran2yl)methyl)sulfamoyl)phenyl)phthalazin1yl)amino)phenoxy)acetamide
NMETHYL2(4((4(4METHYL3(OXOLAN2YLMETHYLSULFAMOYL)PHENYL)PHTHALAZIN1YL)AMINO)PHENOXY)ACETAMIDE
STK068657
ZINC000049626548
ZINC000049626550

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Available files

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