Vitas-M small molecule compound
2-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-nitrophenyl)acetamide
Catalog ID
STK400884
SMILES CCn1c(SCC(=O)Nc2cccc(c2)[N+](=O)[O-])nnc1COc1ccc(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 C19H18ClN5O4S MW 447.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN5O4S/c1-2-24-17(11-29-16-8-6-13(20)7-9-16)22-23-19(24)30-12-18(26)21-14-4-3-5-15(10-14)25(27)28/h3-10H,2,11-12H2,1H3,(H,21,26)InChIKey
OZWQCCSAZVYNSH-UHFFFAOYSA-NSynonyms
2((5((4chlorophenoxy)methyl)4ethyl124triazol3yl)sulfanyl)N(3nitrophenyl)acetamide
2((5((4chlorophenoxy)methyl)4ethyl4H124triazol3yl)sulfanyl)N(3nitrophenyl)acetamide
2(5((4CHLOROPHENOXY)METHYL)4ETHYL(124TRIAZOL3YLTHIO))N(3NITROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)(N+)(=O)(O))COC3=CC=C(C=C3)Cl
CCn1c(SCC(=O)Nc2cccc(c2)(N+)(=O)(O))nnc1COc1ccc(cc1)Cl
InChI=1SC19H18ClN5O4Sc122417(1129168613(20)7916)222319(24)301218(26)211443515(1014)25(27)28h310H21112H21H3(H2126)
MFCD02591401
ZINC000000876300
ZINC00876300
ZINC876300
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