Vitas-M small molecule compound
N-[(2-chloro-5-nitrophenyl)carbamothioyl]-3,4-dimethoxybenzamide
Catalog ID
STL495630
SMILES COc1cc(ccc1OC)C(=O)NC(=S)Nc1cc(ccc1Cl)[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 C16H14ClN3O5S MW 395.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O5S/c1-24-13-6-3-9(7-14(13)25-2)15(21)19-16(26)18-12-8-10(20(22)23)4-5-11(12)17/h3-8H,1-2H3,(H2,18,19,21,26)InChIKey
HAAISAIGCVOVPO-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)(N+)(=O)(O))Cl)OC
COc1cc(ccc1OC)C(=O)NC(=S)Nc1cc(ccc1Cl)(N+)(=O)(O)
InChI=1SC16H14ClN3O5Sc12413639(714(13)252)15(21)1916(26)1812810(20(22)23)4511(12)17h38H12H3(H218192126)
MFCD02809961
N((2CHLORO5NITROPHENYL)CARBAMOTHIOYL)34DIMETHOXYBENZAMIDE
ZINC000002982023
ZINC02982023
ZINC2982023
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