Vitas-M small molecule compound

2-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-4-methyl-6-nitrophenol

Catalog ID
STK761495
SMILES Cc1cc(C2SCc3c(CS2)cc(c(c3)C)C)c(c(c1)[N+](=O)[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 C18H19NO3S2 MW 361.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO3S2/c1-10-4-15(17(20)16(5-10)19(21)22)18-23-8-13-6-11(2)12(3)7-14(13)9-24-18/h4-7,18,20H,8-9H2,1-3H3
InChIKey
QPRUXZUWBOXDEZ-UHFFFAOYSA-N
Synonyms
309286-75-7
2(78dimethyl15dihydro24benzodithiepin3yl)4methyl6nitrophenol
2(78dimethyl15dihydrobenzo(e)(13)dithiepin3yl)4methyl6nitrophenol
309286757
CC1=CC(=C(C(=C1)C2SCC3=CC(=C(C=C3CS2)C)C)O)(N+)(=O)(O)
Cc1cc(C2SCc3c(CS2)cc(c(c3)C)C)c(c(c1)(N+)(=O)(O))O
InChI=1SC18H19NO3S2c110415(17(20)16(510)19(21)22)1823813611(2)12(3)714(13)92418h471820H89H213H3
MFCD01828912
PHENOL4METHYL2(78DIMETHYLBENZO(E)DITHIEPAN2YL)6NITRO
ZINC000012445135
ZINC12445135

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Available files

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