Vitas-M small molecule compound
N-(4-chloro-3-nitrophenyl)-2-({5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK434860
SMILES O=C(Nc1ccc(c(c1)[N+](=O)[O-])Cl)CSc1nnc(n1C)CCn1nc(c(c1C)[N+](=O)[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 C18H19ClN8O5S MW 494.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN8O5S/c1-10-17(27(31)32)11(2)25(23-10)7-6-15-21-22-18(24(15)3)33-9-16(28)20-12-4-5-13(19)14(8-12)26(29)30/h4-5,8H,6-7,9H2,1-3H3,(H,20,28)InChIKey
PGLLWFYLQAAHPD-UHFFFAOYSA-NSynonyms
2(5(2(35DIMETHYL4NITROPYRAZOLYL)ETHYL)4METHYL(124TRIAZOL3YLTHIO))N(4CHLORO3NITROPHENYL)ACETAMIDE
CC1=C(C(=NN1CCC2=NN=C(N2C)SCC(=O)NC3=CC(=C(C=C3)Cl)(N+)(=O)(O))C)(N+)(=O)(O)
InChI=1SC18H19ClN8O5Sc11017(27(31)32)11(2)25(2310)7615212218(24(15)3)33916(28)20124513(19)14(812)26(29)30h458H679H213H3(H2028)
MFCD03943237
N(4chloro3nitrophenyl)2((5(2(35dimethyl4nitro1Hpyrazol1yl)ethyl)4methyl4H124triazol3yl)sulfanyl)acetamide
N(4CHLORO3NITROPHENYL)2((5(2(35DIMETHYL4NITROPYRAZOL1YL)ETHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
O=C(Nc1ccc(c(c1)(N+)(=O)(O))Cl)CSc1nnc(n1C)CCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000020294293
ZINC20294293
Check stock
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