Vitas-M small molecule compound
2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methyl-4-nitrophenyl)acetamide
Catalog ID
STK115376
SMILES CCn1c(SCC(=O)Nc2ccc(cc2C)[N+](=O)[O-])nnc1c1ccc(cc1)Cl
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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 C19H18ClN5O3S MW 431.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5O3S/c1-3-24-18(13-4-6-14(20)7-5-13)22-23-19(24)29-11-17(26)21-16-9-8-15(25(27)28)10-12(16)2/h4-10H,3,11H2,1-2H3,(H,21,26)InChIKey
ZQNCKSWTKZGTJY-UHFFFAOYSA-NSynonyms
2((5(4CHLOROPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(2METHYL4NITROPHENYL)ACETAMIDE
2((5(4CHLOROPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(2METHYL4NITROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)(N+)(=O)(O))C)C3=CC=C(C=C3)Cl
CCn1c(SCC(=O)Nc2ccc(cc2C)(N+)(=O)(O))nnc1c1ccc(cc1)Cl
InChI=1SC19H18ClN5O3Sc132418(134614(20)7513)222319(24)291117(26)21169815(25(27)28)1012(16)2h410H311H212H3(H2126)
MFCD02229802
ZINC000009070847
ZINC09070847
ZINC9070847
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