Vitas-M small molecule compound
3-(3-bromophenyl)-10-ethoxy-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Catalog ID
STL094398
SMILES CCOc1cccc2c1OC1(C)CC2NC(=S)N1c1cccc(c1)Br
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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 C19H19BrN2O2S MW 419.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrN2O2S/c1-3-23-16-9-5-8-14-15-11-19(2,24-17(14)16)22(18(25)21-15)13-7-4-6-12(20)10-13/h4-10,15H,3,11H2,1-2H3,(H,21,25)InChIKey
JAPCSLKCTRZMJY-UHFFFAOYSA-NSynonyms
3(3bromophenyl)10ethoxy2methyl2356tetrahydro4H26methano135benzoxadiazocine4thione
CCOC1=CC=CC2=C1OC3(CC2NC(=S)N3C4=CC(=CC=C4)Br)C
InChI=1SC19H19BrN2O2Sc13231695814151119(22417(14)16)22(18(25)2115)1374612(20)1013h41015H311H212H3(H2125)
MFCD15086244
ZINC000002963414
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