Vitas-M small molecule compound
1-(4-chloro-2,5-dimethoxyphenyl)-3-(2-methoxy-4-nitrophenyl)thiourea
Catalog ID
STK455404
SMILES COc1cc(ccc1NC(=S)Nc1cc(OC)c(cc1OC)Cl)[N+](=O)[O-]
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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 C16H16ClN3O5S MW 397.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O5S/c1-23-13-8-12(15(25-3)7-10(13)17)19-16(26)18-11-5-4-9(20(21)22)6-14(11)24-2/h4-8H,1-3H3,(H2,18,19,26)InChIKey
NBVUOJOYANIGHT-UHFFFAOYSA-NSynonyms
((4CHLORO25DIMETHOXYPHENYL)AMINO)((2METHOXY4NITROPHENYL)AMINO)METHANE1THIONE
1(4chloro25dimethoxyphenyl)3(2methoxy4nitrophenyl)thiourea
COC1=CC(=C(C=C1NC(=S)NC2=C(C=C(C=C2)(N+)(=O)(O))OC)OC)Cl
COc1cc(ccc1NC(=S)Nc1cc(OC)c(cc1OC)Cl)(N+)(=O)(O)
InChI=1SC16H16ClN3O5Sc12313812(15(253)710(13)17)1916(26)1811549(20(21)22)614(11)242h48H13H3(H2181926)
MFCD04228474
ZINC000005041327
ZINC05041327
ZINC5041327
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