Vitas-M small molecule compound

2-[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)acetamide

Catalog ID
STL365955
SMILES O=C(Nc1ccc2c(c1)[nH]c(=O)[nH]2)CSc1nnc(n1C)CN(S(=O)(=O)C)c1ccccc1

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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 C20H21N7O4S2 MW 487.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N7O4S2/c1-26-17(11-27(33(2,30)31)14-6-4-3-5-7-14)24-25-20(26)32-12-18(28)21-13-8-9-15-16(10-13)23-19(29)22-15/h3-10H,11-12H2,1-2H3,(H,21,28)(H2,22,23,29)
InChIKey
FOZCIWMBNPCLHR-UHFFFAOYSA-N
Synonyms

2((4methyl5(((methylsulfonyl)(phenyl)amino)methyl)4H124triazol3yl)sulfanyl)N(2oxo23dihydro1Hbenzimidazol5yl)acetamide
2((4methyl5((Nmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)N(2oxo13dihydrobenzimidazol5yl)acetamide
CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)NC(=O)N3)CN(C4=CC=CC=C4)S(=O)(=O)C
InChI=1SC20H21N7O4S2c12617(1127(33(230)31)146435714)242520(26)321218(28)2113891516(1013)2319(29)2215h310H1112H212H3(H2128)(H2222329)
MFCD14833864
O=C(Nc1ccc2c(c1)(nH)c(=O)(nH)2)CSc1nnc(n1C)CN(S(=O)(=O)C)c1ccccc1
ZINC000015019746
ZINC15019746

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Available files

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