Vitas-M small molecule compound

N-tert-butyl-5-(4-{[4-methoxy-3-(piperidin-1-ylcarbonyl)phenyl]amino}phthalazin-1-yl)-2-methylbenzenesulfonamide

Catalog ID
STK546167
SMILES COc1ccc(cc1C(=O)N1CCCCC1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)NC(C)(C)C)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 C32H37N5O4S MW 587.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H37N5O4S/c1-21-13-14-22(19-28(21)42(39,40)36-32(2,3)4)29-24-11-7-8-12-25(24)30(35-34-29)33-23-15-16-27(41-5)26(20-23)31(38)37-17-9-6-10-18-37/h7-8,11-16,19-20,36H,6,9-10,17-18H2,1-5H3,(H,33,35)
InChIKey
FJUQLGPXOPZKGO-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)OC)C(=O)N5CCCCC5)S(=O)(=O)NC(C)(C)C
InChI=1SC32H37N5O4Sc121131422(1928(21)42(3940)3632(23)4)292411781225(24)30(353429)3323151627(415)26(2023)31(38)371796101837h781116192036H69101718H215H3(H3335)
MFCD03664460
N(tertbutyl)5(4((4methoxy3(piperidine1carbonyl)phenyl)amino)phthalazin1yl)2methylbenzenesulfonamide
Ntertbutyl5(4((4methoxy3(piperidin1ylcarbonyl)phenyl)amino)phthalazin1yl)2methylbenzenesulfonamide
NTERTBUTYL5(4(4METHOXY3(PIPERIDINE1CARBONYL)ANILINO)PHTHALAZIN1YL)2METHYLBENZENESULFONAMIDE
ZINC000001274000
ZINC01274000
ZINC1274000

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Available files

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