Vitas-M small molecule compound
N-[4-(4-ethyl-5-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]acetamide
Catalog ID
STK140503
SMILES CCn1c(SCC(=O)c2ccc(cc2)[N+](=O)[O-])nnc1c1ccc(cc1)NC(=O)C
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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 C20H19N5O4S MW 425.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O4S/c1-3-24-19(15-4-8-16(9-5-15)21-13(2)26)22-23-20(24)30-12-18(27)14-6-10-17(11-7-14)25(28)29/h4-11H,3,12H2,1-2H3,(H,21,26)InChIKey
BFVJUSHGJCRNKQ-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C3=CC=C(C=C3)NC(=O)C
CCn1c(SCC(=O)c2ccc(cc2)(N+)(=O)(O))nnc1c1ccc(cc1)NC(=O)C
InChI=1SC20H19N5O4Sc132419(154816(9515)2113(2)26)222320(24)301218(27)1461017(11714)25(28)29h411H312H212H3(H2126)
MFCD03878330
N(4(4ETHYL5((2(4NITROPHENYL)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)PHENYL)ACETAMIDE
N(4(4ETHYL5(2(4NITROPHENYL)2OXOETHYL)SULFANYL124TRIAZOL3YL)PHENYL)ACETAMIDE
ZINC000013880089
ZINC13880089
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