Vitas-M small molecule compound

2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-phenyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide

Catalog ID
STK058821
SMILES O=C(C(N1C(=O)C2C(C1=O)CCCC2)Cc1ccccc1)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1

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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 C27H27N5O5S MW 533.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O5S/c33-24(30-19-11-13-20(14-12-19)38(36,37)31-27-28-15-6-16-29-27)23(17-18-7-2-1-3-8-18)32-25(34)21-9-4-5-10-22(21)26(32)35/h1-3,6-8,11-16,21-23H,4-5,9-10,17H2,(H,30,33)(H,28,29,31)
InChIKey
XVQKDXYRBZICOZ-UHFFFAOYSA-N
Synonyms
459147-37-6
2(13dioxo3a45677ahexahydroisoindol2yl)3phenylN(4(pyrimidin2ylsulfamoyl)phenyl)propanamide
2(13dioxohexahydro1Hisoindol2(3H)yl)3phenylN(4(N(pyrimidin2yl)sulfamoyl)phenyl)propanamide
2(13DIOXOOCTAHYDRO2HISOINDOL2YL)3PHENYLN(4(PYRIMIDIN2YLSULFAMOYL)PHENYL)PROPANAMIDE
459147376
C1CCC2C(C1)C(=O)N(C2=O)C(CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5
InChI=1SC27H27N5O5Sc3324(3019111320(141219)38(3637)312728156162927)23(17187213818)3225(34)219451022(21)26(32)35h136811162123H4591017H2(H3033)(H282931)
MFCD03010297
O=C(C(N1C(=O)C2C(C1=O)CCCC2)Cc1ccccc1)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
STK058821
ZINC000004647322
ZINC000253498042

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Available files

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