Vitas-M small molecule compound

N-methyl-4-{[4-(4-methyl-3-sulfamoylphenyl)phthalazin-1-yl]amino}benzamide

Catalog ID
STK082178
SMILES CNC(=O)c1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N)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 C23H21N5O3S MW 447.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O3S/c1-14-7-8-16(13-20(14)32(24,30)31)21-18-5-3-4-6-19(18)22(28-27-21)26-17-11-9-15(10-12-17)23(29)25-2/h3-13H,1-2H3,(H,25,29)(H,26,28)(H2,24,30,31)
InChIKey
VXNFFSKGUCCDQY-UHFFFAOYSA-N
Synonyms

4((4(3(AMINOSULFONYL)4METHYLPHENYL)PHTHALAZIN1YL)AMINO)NMETHYLBENZAMIDE
CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)C(=O)NC)S(=O)(=O)N
CNC(=O)c1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N)C
InChI=1SC23H21N5O3Sc1147816(1320(14)32(2430)31)2118534619(18)22(282721)261711915(101217)23(29)252h313H12H3(H2529)(H2628)(H2243031)
MFCD02164753
NMETHYL4((4(4METHYL3SULFAMOYLPHENYL)PHTHALAZIN1YL)AMINO)BENZAMIDE
STK082178
ZINC000000971866
ZINC00971866
ZINC971866

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Available files

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