Vitas-M small molecule compound
2-({5-[3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-sulfamoylphenyl)acetamide
Catalog ID
STL444010
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1CCCn1c(=O)c2cccc3c2c(c1=O)ccc3
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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 C28H26N6O5S2 MW 590.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N6O5S2/c1-2-15-33-23(31-32-28(33)40-17-24(35)30-19-11-13-20(14-12-19)41(29,38)39)10-5-16-34-26(36)21-8-3-6-18-7-4-9-22(25(18)21)27(34)37/h2-4,6-9,11-14H,1,5,10,15-17H2,(H,30,35)(H2,29,38,39)InChIKey
ZMRUQYJSRLCLLA-UHFFFAOYSA-NSynonyms
2((4ALLYL5(3(13DIOXO1HBENZO(DE)ISOQUINOLIN2(3H)YL)PROPYL)4H124TRIAZOL3YL)SULFANYL)N(4(AMINOSULFONYL)PHENYL)ACETAMIDE
2((5(3(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)propyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4sulfamoylphenyl)acetamide
2((5(3(13DIOXOBENZO(DE)ISOQUINOLIN2YL)PROPYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4SULFAMOYLPHENYL)ACETAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N)CCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O
InChI=1SC28H26N6O5S2c12153323(313228(33)401724(35)3019111320(141219)41(2938)39)105163426(36)218361874922(25(18)21)27(34)37h24691114H15101517H2(H3035)(H2293839)
MFCD03622260
ZINC000008433335
ZINC08433335
ZINC8433335
Check stock
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Check stock on Vitas-MAvailable files
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