Vitas-M small molecule compound

4-{[4-(3-{[2-(3,4-diethoxyphenyl)ethyl]sulfamoyl}-4-methylphenyl)phthalazin-1-yl]amino}benzamide

Catalog ID
STK678544
SMILES CCOc1cc(CCNS(=O)(=O)c2cc(ccc2C)c2nnc(c3c2cccc3)Nc2ccc(cc2)C(=O)N)ccc1OCC

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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 C34H35N5O5S MW 625.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H35N5O5S/c1-4-43-29-17-11-23(20-30(29)44-5-2)18-19-36-45(41,42)31-21-25(12-10-22(31)3)32-27-8-6-7-9-28(27)34(39-38-32)37-26-15-13-24(14-16-26)33(35)40/h6-17,20-21,36H,4-5,18-19H2,1-3H3,(H2,35,40)(H,37,39)
InChIKey
CUKUUPKXEAQVCZ-UHFFFAOYSA-N
Synonyms

4((4(3((2(34diethoxyphenyl)ethyl)sulfamoyl)4methylphenyl)phthalazin1yl)amino)benzamide
4((4(3(2(34DIETHOXYPHENYL)ETHYLSULFAMOYL)4METHYLPHENYL)PHTHALAZIN1YL)AMINO)BENZAMIDE
CCOC1=C(C=C(C=C1)CCNS(=O)(=O)C2=C(C=CC(=C2)C3=NN=C(C4=CC=CC=C43)NC5=CC=C(C=C5)C(=O)N)C)OCC
InChI=1SC34H35N5O5Sc144329171123(2030(29)4452)18193645(4142)312125(121022(31)3)3227867928(27)34(393832)3726151324(141626)33(35)40h617202136H451819H213H3(H23540)(H3739)
MFCD03308583
ZINC000004030403
ZINC4030403

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Available files

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