Vitas-M small molecule compound
2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-nitrophenol
Catalog ID
STK367249
SMILES Oc1ccc(cc1CSc1nc2c(s1)cccc2)[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 C14H10N2O3S2 MW 318.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10N2O3S2/c17-12-6-5-10(16(18)19)7-9(12)8-20-14-15-11-3-1-2-4-13(11)21-14/h1-7,17H,8H2InChIKey
CGEPAPDYIGBMGO-UHFFFAOYSA-NSynonyms
2((13benzothiazol2ylsulfanyl)methyl)4nitrophenol
2(13BENZOTHIAZOL2YLSULFANYLMETHYL)4NITROPHENOL
2(BENZOTHIAZOL2YLTHIOMETHYL)4NITROPHENOL
C1=CC=C2C(=C1)N=C(S2)SCC3=C(C=CC(=C3)(N+)(=O)(O))O
InChI=1SC14H10N2O3S2c17126510(16(18)19)79(12)820141511312413(11)2114h1717H8H2
MFCD00418373
Oc1ccc(cc1CSc1nc2c(s1)cccc2)(N+)(=O)(O)
ZINC000035406194
ZINC35406194
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