Vitas-M small molecule compound
1-[(1,5-dimethyl-1H-pyrazol-3-yl)methyl]-3-(3-nitrophenyl)thiourea
Catalog ID
STK455347
SMILES S=C(Nc1cccc(c1)[N+](=O)[O-])NCc1nn(c(c1)C)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 C13H15N5O2S MW 305.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N5O2S/c1-9-6-11(16-17(9)2)8-14-13(21)15-10-4-3-5-12(7-10)18(19)20/h3-7H,8H2,1-2H3,(H2,14,15,21)InChIKey
KHJIOYBKUYWTRZ-UHFFFAOYSA-NSynonyms
(((15DIMETHYLPYRAZOL3YL)METHYL)AMINO)((3NITROPHENYL)AMINO)METHANE1THIONE
1((15dimethyl1Hpyrazol3yl)methyl)3(3nitrophenyl)thiourea
1((15DIMETHYLPYRAZOL3YL)METHYL)3(3NITROPHENYL)THIOUREA
CC1=CC(=NN1C)CNC(=S)NC2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC13H15N5O2Sc19611(1617(9)2)81413(21)151043512(710)18(19)20h37H8H212H3(H2141521)
MFCD04137124
S=C(Nc1cccc(c1)(N+)(=O)(O))NCc1nn(c(c1)C)C
ZINC000000610871
ZINC00610871
ZINC610871
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