Vitas-M small molecule compound
4-(3-chlorophenyl)-5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK302502
SMILES Clc1cccc(c1)n1c(nnc1S)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 C15H15ClN6O2S MW 378.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN6O2S/c1-9-14(22(23)24)10(2)20(19-9)7-6-13-17-18-15(25)21(13)12-5-3-4-11(16)8-12/h3-5,8H,6-7H2,1-2H3,(H,18,25)InChIKey
AYXPYKKKQZYSCD-UHFFFAOYSA-NSynonyms
512825-82-04(3CHLOROPHENYL)3(2(35DIMETHYL4NITRO1PYRAZOLYL)ETHYL)1H124TRIAZOLE5THIONE
4(3CHLOROPHENYL)3(2(35DIMETHYL4NITROPYRAZOL1YL)ETHYL)1H124TRIAZOLE5THIONE
4(3CHLOROPHENYL)3(2(4NITRO35DIMETHYL1HPYRAZOL1YL)ETHYL)5SULFANYL4H124TRIAZOLE
4(3chlorophenyl)5(2(35dimethyl4nitro1Hpyrazol1yl)ethyl)4H124triazole3thiol
512825820
CC1=C(C(=NN1CCC2=NNC(=S)N2C3=CC(=CC=C3)Cl)C)(N+)(=O)(O)
Clc1cccc(c1)n1c(nnc1S)CCn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC15H15ClN6O2Sc1914(22(23)24)10(2)20(199)7613171815(25)21(13)1253411(16)812h358H67H212H3(H1825)
MFCD03468732
ZINC000005424995
ZINC5424995
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