Vitas-M small molecule compound

(5E)-N-hydroxy-3,4-dihydro-1-benzothiepin-5(2H)-imine

Catalog ID
STL172663
SMILES O/N=C/1\CCCSc2c1cccc2

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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 C10H11NOS MW 193.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11NOS/c12-11-9-5-3-7-13-10-6-2-1-4-8(9)10/h1-2,4,6,12H,3,5,7H2/b11-9+
InChIKey
VFJJDUKSHZJVKP-PKNBQFBNSA-N
Synonyms
5583-39-1
(5E)Nhydroxy34dihydro1benzothiepin5(2H)imine
(NE)N(34DIHYDRO2H1BENZOTHIEPIN5YLIDENE)HYDROXYLAMINE
5(HYDROXYIMINO)2H3H4HBENZO(F)THIEPIN
5583391
C1CC(=NO)C2=CC=CC=C2SC1
InChI=1SC10H11NOSc12119537131062148(9)10h124612H357H2b119+
MFCD00090364
ON=C1CCCSc2c1cccc2
ZINC000004502442
ZINC04502442
ZINC100302388

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.