Vitas-M small molecule compound
2-chloro-N-{3-[(2,3-dihydroxypropyl)sulfanyl]-5-nitrophenyl}-5-(1H-tetrazol-1-yl)benzamide
Catalog ID
STL176158
SMILES OCC(CSc1cc(cc(c1)[N+](=O)[O-])NC(=O)c1cc(ccc1Cl)n1cnnn1)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 C17H15ClN6O5S MW 450.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClN6O5S/c18-16-2-1-11(23-9-19-21-22-23)6-15(16)17(27)20-10-3-12(24(28)29)5-14(4-10)30-8-13(26)7-25/h1-6,9,13,25-26H,7-8H2,(H,20,27)InChIKey
LIPZBKDXVRKSSK-UHFFFAOYSA-NSynonyms
438236-65-82CHLORON(3((23DIHYDROXYPROPYL)SULFANYL)5NITROPHENYL)5(1HTETRAAZOL1YL)BENZAMIDE
2chloroN(3((23dihydroxypropyl)sulfanyl)5nitrophenyl)5(1Htetrazol1yl)benzamide
2CHLORON(3(23DIHYDROXYPROPYLSULFANYL)5NITROPHENYL)5(TETRAZOL1YL)BENZAMIDE
438236658
C1=CC(=C(C=C1N2C=NN=N2)C(=O)NC3=CC(=CC(=C3)SCC(CO)O)(N+)(=O)(O))Cl
InChI=1SC17H15ClN6O5Sc18162111(23919212223)615(16)17(27)2010312(24(28)29)514(410)30813(26)725h169132526H78H2(H2027)
MFCD03468086
OCC(CSc1cc(cc(c1)(N+)(=O)(O))NC(=O)c1cc(ccc1Cl)n1cnnn1)O
ZINC000002112390
ZINC000008455412
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