Vitas-M small molecule compound
1-(2-methyl-5-nitrophenyl)-3-(tetrahydrofuran-2-ylmethyl)thiourea
Catalog ID
STK467453
SMILES S=C(Nc1cc(ccc1C)[N+](=O)[O-])NCC1CCCO1
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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 C13H17N3O3S MW 295.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O3S/c1-9-4-5-10(16(17)18)7-12(9)15-13(20)14-8-11-3-2-6-19-11/h4-5,7,11H,2-3,6,8H2,1H3,(H2,14,15,20)InChIKey
LWLFBYMWTSWMNI-UHFFFAOYSA-NSynonyms
((2METHYL5NITROPHENYL)AMINO)((OXOLAN2YLMETHYL)AMINO)METHANE1THIONE
1(2METHYL5NITROPHENYL)3(OXOLAN2YLMETHYL)THIOUREA
1(2methyl5nitrophenyl)3(tetrahydrofuran2ylmethyl)thiourea
CC1=C(C=C(C=C1)(N+)(=O)(O))NC(=S)NCC2CCCO2
InChI=1SC13H17N3O3Sc194510(16(17)18)712(9)1513(20)148113261911h45711H2368H21H3(H2141520)
MFCD02189861
S=C(Nc1cc(ccc1C)(N+)(=O)(O))NCC1CCCO1
ZINC000005062861
ZINC000005062862
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