Vitas-M small molecule compound
2-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-4-nitrophenol
Catalog ID
STK761499
SMILES Oc1ccc(cc1C1SCc2c(CS1)cc(c(c2)C)C)[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 C17H17NO3S2 MW 347.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO3S2/c1-10-5-12-8-22-17(23-9-13(12)6-11(10)2)15-7-14(18(20)21)3-4-16(15)19/h3-7,17,19H,8-9H2,1-2H3InChIKey
SOUQCGZPYLBAKF-UHFFFAOYSA-NSynonyms
309286-79-12(78DIMETHYL(1H3H5HBENZO(E)13DITHIEPIN3YL))4NITROPHENOL
2(78dimethyl15dihydro24benzodithiepin3yl)4nitrophenol
2(78DIMETHYL15DIHYDROBENZO(E)(13)DITHIEPIN3YL)4NITROPHENOL
309286791
CC1=C(C=C2CSC(SCC2=C1)C3=C(C=CC(=C3)(N+)(=O)(O))O)C
InChI=1SC17H17NO3S2c11051282217(23913(12)611(10)2)15714(18(20)21)3416(15)19h371719H89H212H3
MFCD01828865
Oc1ccc(cc1C1SCc2c(CS1)cc(c(c2)C)C)(N+)(=O)(O)
PHENOL4NITRO2(67DIMETHYLBENZO(E)DITHIEPAN2YL)
ZINC000035974026
ZINC35974026
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