Vitas-M small molecule compound

1-[(4-chlorophenyl)sulfonyl]-N,N'-bis(4-ethoxybenzyl)-1H-1,2,4-triazole-3,5-diamine

Catalog ID
STK178997
SMILES CCOc1ccc(cc1)CNc1nc(n(n1)S(=O)(=O)c1ccc(cc1)Cl)NCc1ccc(cc1)OCC

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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 C26H28ClN5O4S MW 542.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28ClN5O4S/c1-3-35-22-11-5-19(6-12-22)17-28-25-30-26(29-18-20-7-13-23(14-8-20)36-4-2)32(31-25)37(33,34)24-15-9-21(27)10-16-24/h5-16H,3-4,17-18H2,1-2H3,(H2,28,29,30,31)
InChIKey
JXJGOKFRTZMEBX-UHFFFAOYSA-N
Synonyms

1((4CHLOROPHENYL)SULFONYL)NNBIS(4ETHOXYBENZYL)1H124TRIAZOLE35DIAMINE
1(4chlorophenyl)sulfonyl3N5Nbis((4ethoxyphenyl)methyl)124triazole35diamine
CCOC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)OCC)S(=O)(=O)C4=CC=C(C=C4)Cl
InChI=1SC26H28ClN5O4Sc13352211519(61222)1728253026(29182071323(14820)3642)32(3125)37(3334)2415921(27)101624h516H341718H212H3(H228293031)
MFCD06664059
ZINC000097995290
ZINC97995290

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Available files

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